2-[3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazolo[3,4-b]pyridin-5-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol;5-(1,3-oxazol-2-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol

C61H69N21O4 — CID 161301004

IUPAC2-[3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazolo[3,4-b]pyridin-5-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol;5-(1,3-oxazol-2-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol
SMILESCC(C)NC1CCN(c2ncc(-c3ccc(-c4cnc5c(cnn5C)c4)cc3O)nn2)C1.CC(C)NC1CCN(c2ncc(-c3ccc(-c4ncco4)cc3O)nn2)C1.Oc1cc(-c2cn[nH]c2)ccc1-c1cnc(N2C[C@@H]3CCCN[C@@H]3C2)nn1
InChIInChI=1S/C23H26N8O.C19H21N7O.C19H22N6O2/c1-14(2)27-18-6-7-31(13-18)23-25-12-20(28-29-23)19-5-4-15(9-21(19)32)16-8-17-11-26-30(3)22(17)24-10-16;27-18-6-12(14-7-22-23-8-14)3-4-15(18)16-9-21-19(25-24-16)26-10-13-2-1-5-20-17(13)11-26;1-12(2)22-14-5-7-25(11-14)19-21-10-16(23-24-19)15-4-3-13(9-17(15)26)18-20-6-8-27-18/h4-5,8-12,14,18,27,32H,6-7,13H2,1-3H3;3-4,6-9,13,17,20,27H,1-2,5,10-11H2,(H,22,23);3-4,6,8-10,12,14,22,26H,5,7,11H2,1-2H3/t;13-,17+;/m.0./s1
InChIKeyVHPQKOFLGUYDFR-XXCUDZQASA-N
MW1160.37 g/mol
LogP7.07
Rot. Bonds13

About 2-[3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazolo[3,4-b]pyridin-5-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol;5-(1,3-oxazol-2-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol

2-[3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazolo[3,4-b]pyridin-5-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol;5-(1,3-oxazol-2-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol (PubChem CID 161301004) has the molecular formula C61H69N21O4 and a molecular weight of 1160.37 g/mol. Its IUPAC name is 2-[3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazolo[3,4-b]pyridin-5-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol;5-(1,3-oxazol-2-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol.

Molecular Properties

Compound Name2-[3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazolo[3,4-b]pyridin-5-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol;5-(1,3-oxazol-2-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol
PubChem CID161301004
Molecular FormulaC61H69N21O4
Molecular Weight1160.37 g/mol
Exact Mass1159.58
IUPAC Name2-[3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazolo[3,4-b]pyridin-5-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol;5-(1,3-oxazol-2-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol
SMILESCC(C)NC1CCN(c2ncc(-c3ccc(-c4cnc5c(cnn5C)c4)cc3O)nn2)C1.CC(C)NC1CCN(c2ncc(-c3ccc(-c4ncco4)cc3O)nn2)C1.Oc1cc(-c2cn[nH]c2)ccc1-c1cnc(N2C[C@@H]3CCCN[C@@H]3C2)nn1
InChIInChI=1S/C23H26N8O.C19H21N7O.C19H22N6O2/c1-14(2)27-18-6-7-31(13-18)23-25-12-20(28-29-23)19-5-4-15(9-21(19)32)16-8-17-11-26-30(3)22(17)24-10-16;27-18-6-12(14-7-22-23-8-14)3-4-15(18)16-9-21-19(25-24-16)26-10-13-2-1-5-20-17(13)11-26;1-12(2)22-14-5-7-25(11-14)19-21-10-16(23-24-19)15-4-3-13(9-17(15)26)18-20-6-8-27-18/h4-5,8-12,14,18,27,32H,6-7,13H2,1-3H3;3-4,6-9,13,17,20,27H,1-2,5,10-11H2,(H,22,23);3-4,6,8-10,12,14,22,26H,5,7,11H2,1-2H3/t;13-,17+;/m.0./s1
InChIKeyVHPQKOFLGUYDFR-XXCUDZQASA-N
XLogP7.07
TPSA307.93 Ų
H-Bond Donors7
H-Bond Acceptors24
Rotatable Bonds13
Heavy Atoms86
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001160.37
LogP ≤ 57.07
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1024

Analyze 2-[3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazolo[3,4-b]pyridin-5-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol;5-(1,3-oxazol-2-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol with MolForge

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Related Compounds

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1-[7-[5-[[2-[2-[3-ethoxy-4-[4-[2-[4-fluoro-7-(triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl]-2-oxoacetyl]piperazin-1-yl]phenyl]-4-pyridinyl]ethylamino]methyl]-1H-pyrazol-3-yl]-4-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl]-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]ethane-1,2-dione
CID 143573582
7-Amino-4-[5-[2-[3-[4-[2-[7-amino-11-(methylcarbamoyl)-4-pyridin-2-yl-3,5,6,8,10-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]ethyl]piperazin-1-yl]-4-fluorophenyl]-1,3-oxazol-4-yl]-2-pyridinyl]-10-[2-[4-[2-fluoro-5-(1,3-oxazol-2-yl)phenyl]piperazin-1-yl]ethyl]-3,5,6,8,10-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaene-11-carboxylic acid
CID 155579735
1,2-difluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;2-fluoro-3-methyl-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;1-methoxy-2-propan-2-ylbenzene;1-methoxy-3-propan-2-ylbenzene;2-methoxy-4-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;3-methoxy-4-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyrimidine;1-methyl-4-propan-2-ylpyrazole;bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;1-(2-methylpropyl)-4-propan-2-ylpyrazole;3-propan-2-ylfuran;4-propan-2-yl-1-propylpyrazole;4-propan-2-yl-1H-pyrazole;4-propan-2-ylpyridazine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine
CID 159038926
N-(1-acetylazetidin-3-yl)-4-[[4-(cyclopentylmethyl)-5-(2-methyl-1,3-benzoxazol-6-yl)-7H-cyclopenta[d]pyrimidin-2-yl]methyl]-3-methoxybenzamide;4-cyclopentyloxy-N-(1,3-dimethylpyrazol-4-yl)-5-(2-methyl-1,3-benzoxazol-6-yl)-7H-pyrrolo[2,3-d]pyrimidin-2-amine;4-[[4-cyclopentyloxy-5-(2-methyl-1,3-benzoxazol-6-yl)-7H-cyclopenta[d]pyrimidin-2-yl]amino]-N-(2,2-difluoropropyl)-3-methoxybenzamide
CID 159463784
12-[4-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]phenyl]-4-(1-methylpyrazol-4-yl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;12-[3-methoxy-4-(piperidin-1-ylmethyl)phenyl]-4-(1-methylpyrazol-4-yl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;12-[4-[(4-methoxypiperidin-1-yl)methyl]phenyl]-4-(1-methylpyrazol-4-yl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;4-[[4-[4-(1-methylpyrazol-4-yl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-12-yl]phenyl]methyl]morpholine;4-(1-methylpyrazol-4-yl)-12-[4-[[4-(trifluoromethyl)piperidin-1-yl]methyl]phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;5-[12-[4-(piperidin-1-ylmethyl)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-4-yl]-1,3-oxazole
CID 159941433
1,2-difluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;2-fluoro-3-methyl-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;1-methoxy-2-propan-2-ylbenzene;1-methoxy-3-propan-2-ylbenzene;2-methoxy-4-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;3-methoxy-4-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyrimidine;1-methyl-4-propan-2-ylpyrazole;bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;1-(2-methylpropyl)-4-propan-2-ylpyrazole;3-propan-2-ylfuran;4-propan-2-yl-1-propylpyrazole;4-propan-2-yl-1H-pyrazole;3-propan-2-ylpyridine;bis(4-propan-2-ylpyridine);5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine
CID 161200541
1,2-difluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;2-fluoro-3-methyl-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;1-methoxy-2-propan-2-ylbenzene;1-methoxy-3-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;3-methoxy-4-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyrimidine;1-methyl-4-propan-2-ylpyrazole;bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;1-(2-methylpropyl)-4-propan-2-ylpyrazole;3-propan-2-ylfuran;4-propan-2-yl-1-propylpyrazole;4-propan-2-yl-1H-pyrazole;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine
CID 162014760
1,2-difluoro-4-propan-2-ylbenzene;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;2-fluoro-3-methyl-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;1-methoxy-2-propan-2-ylbenzene;1-methoxy-3-propan-2-ylbenzene;2-methoxy-4-propan-2-ylpyridine;bis(2-methoxy-5-propan-2-ylpyridine);3-methoxy-4-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;1-methyl-4-propan-2-ylpyrazole;bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;1-(2-methylpropyl)-4-propan-2-ylpyrazole;3-propan-2-ylfuran;4-propan-2-yl-1-propylpyrazole;4-propan-2-yl-1H-pyrazole;4-propan-2-ylpyridazine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine
CID 162062709
1-[4-[(3S)-3-[5-amino-8-methyl-7-(1,3-oxazol-2-yl)-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl]pyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;[(2S)-2-(5-amino-8-methyl-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-4,4-difluoropyrrolidin-1-yl]-cyclopropylmethanone;2-[5-amino-7-phenyl-2-[(3R)-1-(2,2,2-trifluoroethyl)piperidin-3-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl]propan-2-ol;cis-(1R,3R)-3-[8-amino-5-methyl-6-(1,3-oxazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-yl]-1-methylcyclohexan-1-ol;trans-(1S,3R)-3-[8-amino-5-methyl-6-(1,3-oxazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-yl]-1-methylcyclohexan-1-ol;trans-(1R,3S)-3-[5-amino-8-methyl-7-(1,3-oxazol-2-yl)-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl]-1-methylcyclohexan-1-ol
CID 163536809
CID 164136222
CID 164136222
(2S,4R)-1-[(2S)-2-[7-[[6-cyclopropyl-4-[(4S)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-7-(6-fluoro-5-methyl-1H-indazol-4-yl)-2-(oxan-4-yloxy)quinazolin-8-yl]oxymethyl]-4-oxo-5H-pyrazolo[3,4-c]quinolin-2-yl]-3-methylbutanoyl]-N-[(1R)-1-[8-(2-ethylpyrazol-3-yl)imidazo[1,2-a]pyridin-5-yl]-2-hydroxyethyl]-4-hydroxypyrrolidine-2-carboxamide
CID 176976189

Frequently Asked Questions

What is the IUPAC name of 2-[3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazolo[3,4-b]pyridin-5-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol;5-(1,3-oxazol-2-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol?
The IUPAC name of 2-[3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazolo[3,4-b]pyridin-5-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol;5-(1,3-oxazol-2-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol (CID 161301004) is 2-[3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazolo[3,4-b]pyridin-5-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol;5-(1,3-oxazol-2-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol.
What is the SMILES notation for 2-[3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazolo[3,4-b]pyridin-5-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol;5-(1,3-oxazol-2-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol?
The canonical SMILES for 2-[3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazolo[3,4-b]pyridin-5-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol;5-(1,3-oxazol-2-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol is CC(C)NC1CCN(c2ncc(-c3ccc(-c4cnc5c(cnn5C)c4)cc3O)nn2)C1.CC(C)NC1CCN(c2ncc(-c3ccc(-c4ncco4)cc3O)nn2)C1.Oc1cc(-c2cn[nH]c2)ccc1-c1cnc(N2C[C@@H]3CCCN[C@@H]3C2)nn1.
What is the InChIKey of 2-[3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazolo[3,4-b]pyridin-5-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol;5-(1,3-oxazol-2-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol?
The InChIKey is VHPQKOFLGUYDFR-XXCUDZQASA-N. The full InChI is InChI=1S/C23H26N8O.C19H21N7O.C19H22N6O2/c1-14(2)27-18-6-7-31(13-18)23-25-12-20(28-29-23)19-5-4-15(9-21(19)32)16-8-17-11-26-30(3)22(17)24-10-16;27-18-6-12(14-7-22-23-8-14)3-4-15(18)16-9-21-19(25-24-16)26-10-13-2-1-5-20-17(13)11-26;1-12(2)22-14-5-7-25(11-14)19-21-10-16(23-24-19)15-4-3-13(9-17(15)26)18-20-6-8-27-18/h4-5,8-12,14,18,27,32H,6-7,13H2,1-3H3;3-4,6-9,13,17,20,27H,1-2,5,10-11H2,(H,22,23);3-4,6,8-10,12,14,22,26H,5,7,11H2,1-2H3/t;13-,17+;/m.0./s1.
What are the key properties of 2-[3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazolo[3,4-b]pyridin-5-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol;5-(1,3-oxazol-2-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol?
2-[3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazolo[3,4-b]pyridin-5-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol;5-(1,3-oxazol-2-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol has a molecular weight of 1160.37 g/mol, XLogP of 7.07, 13 rotatable bonds, 7 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazolo[3,4-b]pyridin-5-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol;5-(1,3-oxazol-2-yl)-2-[3-[3-(propan-2-ylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]phenol is sourced from PubChem (CID 161301004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).