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Pyrrolopyrimidiner

Organiske heterocykliske forbindelser, der består af en pyrrolring fusioneret med en pyrimidinring.
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1 – 14 af 14 Resultater
1

1,5-Diazabicyclo[4.3.0]non-5-ene, 98%

CAS: 3001-72-7 Molekylær formel: C7H12N2 Molekylvægt (g/mol): 124.19 MDL nummer: MFCD00005554 InChI nøgle: SGUVLZREKBPKCE-UHFFFAOYSA-N Synonym: 1,5-diazabicyclo 4.3.0 non-5-ene,2,3,4,6,7,8-hexahydropyrrolo 1,2-a pyrimidine,unii-978m4ol12q,2h,3h,4h,6h,7h,8h-pyrrolo 1,2-a pyrimidine,pyrrolo 1,2-a pyrimidine, 2,3,4,6,7,8-hexahydro,1,5-diazabicyclo 4,3,0 non-5-ene,1,5-diazabicyclo 4.3.0-5-nonene,1,5-diazabicyclo-4.3.0 non-5-ene PubChem CID: 76349 IUPAC navn: 2,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrimidin SMIL: C1CN2CCCN=C2C1

MDL nummer MFCD00005554
PubChem CID 76349
Molekylvægt (g/mol) 124.19
CAS 3001-72-7
Synonym 1,5-diazabicyclo 4.3.0 non-5-ene,2,3,4,6,7,8-hexahydropyrrolo 1,2-a pyrimidine,unii-978m4ol12q,2h,3h,4h,6h,7h,8h-pyrrolo 1,2-a pyrimidine,pyrrolo 1,2-a pyrimidine, 2,3,4,6,7,8-hexahydro,1,5-diazabicyclo 4,3,0 non-5-ene,1,5-diazabicyclo 4.3.0-5-nonene,1,5-diazabicyclo-4.3.0 non-5-ene
SMIL C1CN2CCCN=C2C1
IUPAC navn 2,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrimidin
InChI nøgle SGUVLZREKBPKCE-UHFFFAOYSA-N
Molekylær formel C7H12N2
2
Kampagner er tilgængelige

1,5-Diazabicyclo[4.3.0]non-5-ene, 98%

CAS: 3001-72-7 Molekylær formel: C7H12N2 Molekylvægt (g/mol): 124.19 MDL nummer: MFCD00005554 InChI nøgle: SGUVLZREKBPKCE-UHFFFAOYSA-N Synonym: 1,5-diazabicyclo 4.3.0 non-5-ene,2,3,4,6,7,8-hexahydropyrrolo 1,2-a pyrimidine,unii-978m4ol12q,2h,3h,4h,6h,7h,8h-pyrrolo 1,2-a pyrimidine,pyrrolo 1,2-a pyrimidine, 2,3,4,6,7,8-hexahydro,1,5-diazabicyclo 4,3,0 non-5-ene,1,5-diazabicyclo 4.3.0-5-nonene,1,5-diazabicyclo-4.3.0 non-5-ene PubChem CID: 76349 IUPAC navn: 2,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrimidin SMIL: C1CN2CCCN=C2C1

MDL nummer MFCD00005554
PubChem CID 76349
Molekylvægt (g/mol) 124.19
CAS 3001-72-7
Synonym 1,5-diazabicyclo 4.3.0 non-5-ene,2,3,4,6,7,8-hexahydropyrrolo 1,2-a pyrimidine,unii-978m4ol12q,2h,3h,4h,6h,7h,8h-pyrrolo 1,2-a pyrimidine,pyrrolo 1,2-a pyrimidine, 2,3,4,6,7,8-hexahydro,1,5-diazabicyclo 4,3,0 non-5-ene,1,5-diazabicyclo 4.3.0-5-nonene,1,5-diazabicyclo-4.3.0 non-5-ene
SMIL C1CN2CCCN=C2C1
IUPAC navn 2,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrimidin
InChI nøgle SGUVLZREKBPKCE-UHFFFAOYSA-N
Molekylær formel C7H12N2
4

CJ-023423 Hydrochloride Salt, Hydrate, TRC

Molekylær formel: C26H29N5O3S• x(HCl), y(H2O) Molekylvægt (g/mol): 491.6136461802 IUPAC navn: 1-[2-[4-(2-ethyl-4,6-dimethylimidazo[4,5-c]pyridin-1-yl)phenyl]ethyl]-3-(4-methylphenyl)sulfonylurea SMIL: O=S(C1=CC=C(C)C=C1)(NC(NCCC2=CC=C(N3C(CC)=NC4=C3C=C(C)N=C4C)C=C2)=O)=O

Molekylvægt (g/mol) 491.6136461802
SMIL O=S(C1=CC=C(C)C=C1)(NC(NCCC2=CC=C(N3C(CC)=NC4=C3C=C(C)N=C4C)C=C2)=O)=O
IUPAC navn 1-[2-[4-(2-ethyl-4,6-dimethylimidazo[4,5-c]pyridin-1-yl)phenyl]ethyl]-3-(4-methylphenyl)sulfonylurea
Molekylær formel C26H29N5O3S• x(HCl), y(H2O)
5

Tofacitinib impurity N, TRC

CAS: 1260614-73-0 Molekylær formel: C13H19N5 Molekylvægt (g/mol): 245.32 Synonym: N-Methyl-N-((3S,4S)-4-methylpiperidin-3-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine IUPAC navn: N-methyl-N-[(3S,4S)-4-methylpiperidin-3-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine SMIL: C[C@H]1CCNC[C@H]1N(C)c2ncnc3[nH]ccc23

Molekylvægt (g/mol) 245.32
CAS 1260614-73-0
Synonym N-Methyl-N-((3S,4S)-4-methylpiperidin-3-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
SMIL C[C@H]1CCNC[C@H]1N(C)c2ncnc3[nH]ccc23
IUPAC navn N-methyl-N-[(3S,4S)-4-methylpiperidin-3-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Molekylær formel C13H19N5
6

Oclacitinib, TRC

CAS: 1208319-26-9 Molekylær formel: C15H23N5O2S Molekylvægt (g/mol): 337.44 Synonym: trans-N-Methyl-4-(methyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)cyclohexanemethanesulfonamide,JAKi,PF 03394197 IUPAC navn: N-methyl-1-[4-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexyl]methanesulfonamide SMIL: CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)C2=NC=NC3=C2C=CN3

Molekylvægt (g/mol) 337.44
CAS 1208319-26-9
Synonym trans-N-Methyl-4-(methyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)cyclohexanemethanesulfonamide,JAKi,PF 03394197
SMIL CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)C2=NC=NC3=C2C=CN3
IUPAC navn N-methyl-1-[4-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexyl]methanesulfonamide
Molekylær formel C15H23N5O2S
7

6-Chloro-7-deazapurine, TRC

CAS: 3680-69-1 Molekylær formel: C6 H4 Cl N3 Molekylvægt (g/mol): 153.57 Synonym: 7H-Pyrrolo[2,3-d]pyrimidine, 4-chloro- (6CI, 8CI, ACI),1H-Pyrrolo[2,3-d]pyrimidine, 4-chloro- (7CI, 9CI),4-Chloro-7H-pyrrolo[2,3-d]pyrimidine (ACI),4-Chloro-1H-pyrrolo[2,3-d]pyrimidine,4-Chloro-7H-pyrrolo[2,3-d]pyrimidin,4-Chloropyrrolo[2,3-d]pyrimidine,6-Chloro-7-deazapurine,NSC 64952 IUPAC navn: 4-chloro-7H-pyrrolo[2,3-d]pyrimidine SMIL: Clc1ncnc2[nH]ccc12

Molekylvægt (g/mol) 153.57
CAS 3680-69-1
Synonym 7H-Pyrrolo[2,3-d]pyrimidine, 4-chloro- (6CI, 8CI, ACI),1H-Pyrrolo[2,3-d]pyrimidine, 4-chloro- (7CI, 9CI),4-Chloro-7H-pyrrolo[2,3-d]pyrimidine (ACI),4-Chloro-1H-pyrrolo[2,3-d]pyrimidine,4-Chloro-7H-pyrrolo[2,3-d]pyrimidin,4-Chloropyrrolo[2,3-d]pyrimidine,6-Chloro-7-deazapurine,NSC 64952
SMIL Clc1ncnc2[nH]ccc12
IUPAC navn 4-chloro-7H-pyrrolo[2,3-d]pyrimidine
Molekylær formel C6 H4 Cl N3
8

5,6-Dihydro Tofacitinib, TRC

CAS: 1640972-35-5 Molekylær formel: C16H22N6O Molekylvægt (g/mol): 314.39 Synonym: 5,6-Dihydro CP-690550,3-((3R,4R)-3-((6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl)(methyl)amino)-4-methylpiperidin-1-yl)-3-oxopropanenitrile SMIL: O=C(CC#N)N(C1)CC[C@@H](C)[C@H]1N(C)C2=C3C(NCC3)=NC=N2

Molekylvægt (g/mol) 314.39
CAS 1640972-35-5
Synonym 5,6-Dihydro CP-690550,3-((3R,4R)-3-((6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl)(methyl)amino)-4-methylpiperidin-1-yl)-3-oxopropanenitrile
SMIL O=C(CC#N)N(C1)CC[C@@H](C)[C@H]1N(C)C2=C3C(NCC3)=NC=N2
Molekylær formel C16H22N6O
9

Oclacitinib Maleate, TRC

CAS: 1640292-55-2 Molekylær formel: C19H27N5O6S Molekylvægt (g/mol): 453.51 SMIL: CNS(=O)(=O)C[C@@H]1CC[C@H](CC1)N(C)c2ncnc3[nH]ccc23.OC(=O)\C=C/C(=O)O

Molekylvægt (g/mol) 453.51
CAS 1640292-55-2
SMIL CNS(=O)(=O)C[C@@H]1CC[C@H](CC1)N(C)c2ncnc3[nH]ccc23.OC(=O)\C=C/C(=O)O
Molekylær formel C19H27N5O6S
10

2-Chloro-6-methoxy-7-deazapurine, TRC

CAS: 96022-77-4 Molekylær formel: C7 H6 Cl N3 O Molekylvægt (g/mol): 183.6 IUPAC navn: 2-chloro-4-methoxy-3H-pyrrolo[2,3-d]pyrimidine SMIL: COc1[nH]c(Cl)nc2nccc12

Molekylvægt (g/mol) 183.6
CAS 96022-77-4
SMIL COc1[nH]c(Cl)nc2nccc12
IUPAC navn 2-chloro-4-methoxy-3H-pyrrolo[2,3-d]pyrimidine
Molekylær formel C7 H6 Cl N3 O
11

N-Methyl-N-((3R,4R)-4-methylpiperidin-3-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine, TRC

CAS: 477600-74-1 Molekylær formel: C13H19N5 Molekylvægt (g/mol): 245.32 Synonym: (3R,4R)-Methyl{(4-methylpiperidin-3-yl)(7H-pyrrolo[2,3-d]pyrimidin-4-yl)}amine,N-Methyl-N-[(3R,4R)-4-methyl-3-piperidinyl]-1H-Pyrrolo[2,3-d]pyrimidin-4-amine IUPAC navn: N-methyl-N-[(3R,4R)-4-methylpiperidin-3-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine SMIL: C[C@H]1[C@@H](N(C)C2=C(C=CN3)C3=NC=N2)CNCC1

Molekylvægt (g/mol) 245.32
CAS 477600-74-1
Synonym (3R,4R)-Methyl{(4-methylpiperidin-3-yl)(7H-pyrrolo[2,3-d]pyrimidin-4-yl)}amine,N-Methyl-N-[(3R,4R)-4-methyl-3-piperidinyl]-1H-Pyrrolo[2,3-d]pyrimidin-4-amine
SMIL C[C@H]1[C@@H](N(C)C2=C(C=CN3)C3=NC=N2)CNCC1
IUPAC navn N-methyl-N-[(3R,4R)-4-methylpiperidin-3-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Molekylær formel C13H19N5
12

Baricitinib, TRC

CAS: 1187594-09-7 Molekylær formel: C16 H17 N7 O2 S Molekylvægt (g/mol): 371.42 IUPAC navn: 2-[1-ethylsulfonyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]azetidin-3-yl]acetonitrile SMIL: CCS(=O)(=O)N1CC(CC#N)(C1)n2cc(cn2)c3ncnc4[nH]ccc34

Molekylvægt (g/mol) 371.42
CAS 1187594-09-7
SMIL CCS(=O)(=O)N1CC(CC#N)(C1)n2cc(cn2)c3ncnc4[nH]ccc34
IUPAC navn 2-[1-ethylsulfonyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]azetidin-3-yl]acetonitrile
Molekylær formel C16 H17 N7 O2 S
13

9-Deazaguanine, TRC

CAS: 65996-58-9 Molekylær formel: C6 H6 N4 O Molekylvægt (g/mol): 150.14 IUPAC navn: 2-amino-3,5-dihydropyrrolo[3,2-d]pyrimidin-4-one SMIL: NC1=Nc2cc[nH]c2C(=O)N1

Molekylvægt (g/mol) 150.14
CAS 65996-58-9
SMIL NC1=Nc2cc[nH]c2C(=O)N1
IUPAC navn 2-amino-3,5-dihydropyrrolo[3,2-d]pyrimidin-4-one
Molekylær formel C6 H6 N4 O
14

6,7-Dihydro-5H-pyrrolo[3,4-d]pyrimidine dihydrochloride, 95%, Thermo Scientific™

CAS: 157327-51-0 Molekylær formel: C6H7N3·2ClH Molekylvægt (g/mol): 194.06 InChI nøgle: VGQSNQPVXPPLEH-UHFFFAOYSA-N Synonym: 6,7-dihydro-5h-pyrrolo 3,4-d pyrimidine dihydrochloride,5h,6h,7h-pyrrolo 3,4-d pyrimidine dihydrochloride,6,7-dihydro-5h-pyrrolo 3,4-d pyrimidine 2hcl,6,7-dihydro-5h-pyrrolo-3,4-d-pyrimidine dihydrochloride,4-d pyrimidine hydrochloride,6,7-dihydro-5h-pyrrolo 3,4-d pyrimidinedihydrochloride,6,7-dihydro-5h-pyrrolo 3,4-d pyrimidine dihydrochl,5h-pyrrolo 3,4-d pyrimidine,6,7-dihydro-, hydrochloride,5h-pyrrolo 3,4-d pyrimidine,6,7-dihydro-,dihydrochloride,5h-pyrrolo 3,4-d pyrimidine, 6,7-dihydro-, hydrochloride 1:2 PubChem CID: 44182365 IUPAC navn: 6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine;dihydrochloride SMIL: C1C2=CN=CN=C2CN1.Cl.Cl

PubChem CID 44182365
Molekylvægt (g/mol) 194.06
CAS 157327-51-0
Synonym 6,7-dihydro-5h-pyrrolo 3,4-d pyrimidine dihydrochloride,5h,6h,7h-pyrrolo 3,4-d pyrimidine dihydrochloride,6,7-dihydro-5h-pyrrolo 3,4-d pyrimidine 2hcl,6,7-dihydro-5h-pyrrolo-3,4-d-pyrimidine dihydrochloride,4-d pyrimidine hydrochloride,6,7-dihydro-5h-pyrrolo 3,4-d pyrimidinedihydrochloride,6,7-dihydro-5h-pyrrolo 3,4-d pyrimidine dihydrochl,5h-pyrrolo 3,4-d pyrimidine,6,7-dihydro-, hydrochloride,5h-pyrrolo 3,4-d pyrimidine,6,7-dihydro-,dihydrochloride,5h-pyrrolo 3,4-d pyrimidine, 6,7-dihydro-, hydrochloride 1:2
SMIL C1C2=CN=CN=C2CN1.Cl.Cl
IUPAC navn 6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine;dihydrochloride
InChI nøgle VGQSNQPVXPPLEH-UHFFFAOYSA-N
Molekylær formel C6H7N3·2ClH