1-benzyl-4-chloro-N-(4-chlorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-ethylphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide

C131H108Cl8N28O6 — CID 158075513

IUPAC1-benzyl-4-chloro-N-(4-chlorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-ethylphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide
SMILESCC(C)c1ccc(NC(=O)c2cnc3c(cnn3Cc3ccccc3)c2Cl)cc1.CCc1ccc(Cn2ccnc2Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(C)cc4)cnc32)cc1.Cc1ccc(NC(=O)c2cnc3c(cnn3Cc3ccccc3)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(cnn3Cc3cccnc3)c2Cl)cc1.O=C(Nc1ccc(Cl)cc1)c1cnc2c(cnn2Cc2ccccc2)c1Cl.O=C(Nc1ccc(Cl)cc1)c1cnc2c(cnn2Cc2cccnc2)c1Cl
InChIInChI=1S/C28H27ClN6O.C23H21ClN4O.C21H17ClN4O.C20H14Cl2N4O.C20H16ClN5O.C19H13Cl2N5O/c1-4-20-7-9-21(10-8-20)16-34-14-13-30-24(34)17-35-27-25(19(3)33-35)26(29)23(15-31-27)28(36)32-22-11-5-18(2)6-12-22;1-15(2)17-8-10-18(11-9-17)27-23(29)20-12-25-22-19(21(20)24)13-26-28(22)14-16-6-4-3-5-7-16;1-14-7-9-16(10-8-14)25-21(27)18-11-23-20-17(19(18)22)12-24-26(20)13-15-5-3-2-4-6-15;21-14-6-8-15(9-7-14)25-20(27)17-10-23-19-16(18(17)22)11-24-26(19)12-13-4-2-1-3-5-13;1-13-4-6-15(7-5-13)25-20(27)17-10-23-19-16(18(17)21)11-24-26(19)12-14-3-2-8-22-9-14;20-13-3-5-14(6-4-13)25-19(27)16-9-23-18-15(17(16)21)10-24-26(18)11-12-2-1-7-22-8-12/h5-15H,4,16-17H2,1-3H3,(H,32,36);3-13,15H,14H2,1-2H3,(H,27,29);2-12H,13H2,1H3,(H,25,27);1-11H,12H2,(H,25,27);2-11H,12H2,1H3,(H,25,27);1-10H,11H2,(H,25,27)
InChIKeyFMHYLNNQPPTMRS-UHFFFAOYSA-N
MW2454.12 g/mol
LogP29.57
Rot. Bonds28

About 1-benzyl-4-chloro-N-(4-chlorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-ethylphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide

1-benzyl-4-chloro-N-(4-chlorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-ethylphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide (PubChem CID 158075513) has the molecular formula C131H108Cl8N28O6 and a molecular weight of 2454.12 g/mol. Its IUPAC name is 1-benzyl-4-chloro-N-(4-chlorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-ethylphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide.

Molecular Properties

Compound Name1-benzyl-4-chloro-N-(4-chlorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-ethylphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide
PubChem CID158075513
Molecular FormulaC131H108Cl8N28O6
Molecular Weight2454.12 g/mol
Exact Mass2448.65
IUPAC Name1-benzyl-4-chloro-N-(4-chlorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-ethylphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide
SMILESCC(C)c1ccc(NC(=O)c2cnc3c(cnn3Cc3ccccc3)c2Cl)cc1.CCc1ccc(Cn2ccnc2Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(C)cc4)cnc32)cc1.Cc1ccc(NC(=O)c2cnc3c(cnn3Cc3ccccc3)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(cnn3Cc3cccnc3)c2Cl)cc1.O=C(Nc1ccc(Cl)cc1)c1cnc2c(cnn2Cc2ccccc2)c1Cl.O=C(Nc1ccc(Cl)cc1)c1cnc2c(cnn2Cc2cccnc2)c1Cl
InChIInChI=1S/C28H27ClN6O.C23H21ClN4O.C21H17ClN4O.C20H14Cl2N4O.C20H16ClN5O.C19H13Cl2N5O/c1-4-20-7-9-21(10-8-20)16-34-14-13-30-24(34)17-35-27-25(19(3)33-35)26(29)23(15-31-27)28(36)32-22-11-5-18(2)6-12-22;1-15(2)17-8-10-18(11-9-17)27-23(29)20-12-25-22-19(21(20)24)13-26-28(22)14-16-6-4-3-5-7-16;1-14-7-9-16(10-8-14)25-21(27)18-11-23-20-17(19(18)22)12-24-26(20)13-15-5-3-2-4-6-15;21-14-6-8-15(9-7-14)25-20(27)17-10-23-19-16(18(17)22)11-24-26(19)12-13-4-2-1-3-5-13;1-13-4-6-15(7-5-13)25-20(27)17-10-23-19-16(18(17)21)11-24-26(19)12-14-3-2-8-22-9-14;20-13-3-5-14(6-4-13)25-19(27)16-9-23-18-15(17(16)21)10-24-26(18)11-12-2-1-7-22-8-12/h5-15H,4,16-17H2,1-3H3,(H,32,36);3-13,15H,14H2,1-2H3,(H,27,29);2-12H,13H2,1H3,(H,25,27);1-11H,12H2,(H,25,27);2-11H,12H2,1H3,(H,25,27);1-10H,11H2,(H,25,27)
InChIKeyFMHYLNNQPPTMRS-UHFFFAOYSA-N
XLogP29.57
TPSA402.46 Ų
H-Bond Donors6
H-Bond Acceptors28
Rotatable Bonds28
Heavy Atoms173
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002454.12
LogP ≤ 529.57
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1028

Analyze 1-benzyl-4-chloro-N-(4-chlorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-ethylphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide with MolForge

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Related Compounds

4-chloro-N-(4-chlorophenyl)-3-[2-[4-[4-chloro-3-propan-2-yl-5-[[4-(trifluoromethyl)phenyl]carbamoyl]pyrazolo[3,4-b]pyridin-1-yl]phenyl]cyclopropyl]-1-phenylpyrazolo[3,4-b]pyridine-5-carboxamide
CID 135257933
(5-chloro-1H-indazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5,6-difluoro-1H-indazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-imidazol-5-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-methyl-1H-indazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(7-methyl-2H-indazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;2H-pyrazolo[3,4-b]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-pyrrolo[3,2-b]pyridin-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-pyrrolo[2,3-c]pyridin-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 157188127
4-chloro-N-(4-chlorophenyl)-3-cyclopropyl-1-phenylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-ethyl-1-phenylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-phenyl-3-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-phenyl-3-(trifluoromethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-ethyl-N-(4-methylphenyl)-1-phenylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-phenyl-3-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxamide
CID 157189183
4-[[8-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-[(1-methylpiperidin-4-yl)methyl]benzamide;N,N-dimethyl-4-[[8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-methyl-4-[[8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-(2-piperazin-1-ylethyl)-4-[[8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-(piperidin-4-ylmethyl)-4-[[8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-piperidin-4-yl-4-[[8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide
CID 157390910
4-chloro-N-(4-chlorophenyl)-1-(1-ethylpiperidin-4-yl)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-(1-propan-2-ylpiperidin-4-yl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(1-ethylpiperidin-4-yl)-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(1-propan-2-ylpiperidin-4-yl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-(1-methylpiperidin-4-yl)-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide
CID 157559543
4-[8-tert-butyl-6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-2-one;5-[4-[8-tert-butyl-6-(4-fluorophenyl)imidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazine-1-carbonyl]-1H-pyridazin-6-one;4-[6-(4-chloro-3-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-2-one;4-[6-(4-chlorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-2-one;[4-[8-(1,1-difluoroethyl)-6-(4-fluorophenyl)imidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-(5-methyl-1H-pyrazol-3-yl)methanone
CID 157874439
5-Chloro-3-(2-methylpropyl)-1-(1-methylpyrazol-3-yl)pyridin-2-one;5-chloro-3-(2-methylpropyl)-1-(1-methylpyrazol-4-yl)pyridin-2-one;4-[2-chloro-3-(2-methylpropyl)phenyl]-1-methylpyrazole;5-fluoro-3-(2-methylpropyl)-1-(1-methylpyrazol-3-yl)pyridin-2-one;1-[2-(4-methylpiperazin-1-yl)ethyl]-3-propan-2-ylpyrazolo[5,4-b]pyridine;1-[2-(4-methylpiperazin-1-yl)ethyl]-3-propan-2-ylpyrrolo[2,3-b]pyridine;3-(4-methylpiperazin-1-yl)-1-propan-2-ylpyrrolo[3,2-b]pyridine;1-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)pyridin-2-one;3-(2-methylpropyl)-1-(1-methylpyrazol-3-yl)pyridin-2-one;1-(1-methylpyrazol-4-yl)-3-(propan-2-ylamino)-5-(trifluoromethyl)pyridin-2-one
CID 158397739
5-[3-chloro-1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[1-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-5-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)pyrazolo[1,5-a]pyridin-7-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane
CID 158454383
2-[3-chloro-4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1-[5-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-3-pyridinyl]ethanone;2-(2-fluoro-5-methylphenyl)-1-[3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylphenyl]ethanone;N-[3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylphenyl]-1-methylindole-6-carboxamide;1-[3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-5-methylphenyl]-2-[3-(trifluoromethyl)phenyl]ethanone
CID 158598684
5-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;6-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-3-methyl-N-(4-methylphenyl)pyridine-2-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;methane
CID 158604554
7-anilino-6-[[4-(1,1-difluoroethyl)phenyl]methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-3,7-dimethyl-1-(2-methylpropyl)-6-[[4-(1,2,4-triazol-1-yl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-3-methyl-1-(2-methylpropyl)-6-[(4-pyrazol-1-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;3-methyl-5-(N-methylanilino)-1-(2-methylpropyl)-6-[(4-pyrrol-1-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione
CID 158604707
1-[3-[4-(2-Chloro-3-fluorophenyl)piperidine-1-carbonyl]-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl]ethanone;1-[3-[4-(2-chloro-5-fluorophenyl)piperidine-1-carbonyl]-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl]ethanone;1-[3-[4-[3-fluoro-2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl]ethanone;1-[3-[4-[5-fluoro-2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl]ethanone;imidazo[1,2-b]pyridazin-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 158676295

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-4-chloro-N-(4-chlorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-ethylphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide?
The IUPAC name of 1-benzyl-4-chloro-N-(4-chlorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-ethylphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide (CID 158075513) is 1-benzyl-4-chloro-N-(4-chlorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-ethylphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide.
What is the SMILES notation for 1-benzyl-4-chloro-N-(4-chlorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-ethylphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide?
The canonical SMILES for 1-benzyl-4-chloro-N-(4-chlorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-ethylphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide is CC(C)c1ccc(NC(=O)c2cnc3c(cnn3Cc3ccccc3)c2Cl)cc1.CCc1ccc(Cn2ccnc2Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(C)cc4)cnc32)cc1.Cc1ccc(NC(=O)c2cnc3c(cnn3Cc3ccccc3)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(cnn3Cc3cccnc3)c2Cl)cc1.O=C(Nc1ccc(Cl)cc1)c1cnc2c(cnn2Cc2ccccc2)c1Cl.O=C(Nc1ccc(Cl)cc1)c1cnc2c(cnn2Cc2cccnc2)c1Cl.
What is the InChIKey of 1-benzyl-4-chloro-N-(4-chlorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-ethylphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide?
The InChIKey is FMHYLNNQPPTMRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H27ClN6O.C23H21ClN4O.C21H17ClN4O.C20H14Cl2N4O.C20H16ClN5O.C19H13Cl2N5O/c1-4-20-7-9-21(10-8-20)16-34-14-13-30-24(34)17-35-27-25(19(3)33-35)26(29)23(15-31-27)28(36)32-22-11-5-18(2)6-12-22;1-15(2)17-8-10-18(11-9-17)27-23(29)20-12-25-22-19(21(20)24)13-26-28(22)14-16-6-4-3-5-7-16;1-14-7-9-16(10-8-14)25-21(27)18-11-23-20-17(19(18)22)12-24-26(20)13-15-5-3-2-4-6-15;21-14-6-8-15(9-7-14)25-20(27)17-10-23-19-16(18(17)22)11-24-26(19)12-13-4-2-1-3-5-13;1-13-4-6-15(7-5-13)25-20(27)17-10-23-19-16(18(17)21)11-24-26(19)12-14-3-2-8-22-9-14;20-13-3-5-14(6-4-13)25-19(27)16-9-23-18-15(17(16)21)10-24-26(18)11-12-2-1-7-22-8-12/h5-15H,4,16-17H2,1-3H3,(H,32,36);3-13,15H,14H2,1-2H3,(H,27,29);2-12H,13H2,1H3,(H,25,27);1-11H,12H2,(H,25,27);2-11H,12H2,1H3,(H,25,27);1-10H,11H2,(H,25,27).
What are the key properties of 1-benzyl-4-chloro-N-(4-chlorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-ethylphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide?
1-benzyl-4-chloro-N-(4-chlorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-ethylphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide has a molecular weight of 2454.12 g/mol, XLogP of 29.57, 28 rotatable bonds, 6 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-4-chloro-N-(4-chlorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;1-benzyl-4-chloro-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-ethylphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 158075513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).