1-(1-cyclohexylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-(1-cyclopropylpyrazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[1-deuterio-6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylpyrazol-4-yl)ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[1-(2-methylpropyl)pyrrol-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-methylpyrazol-3-yl)ethanone;1-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-3-(1-methylpyrazol-4-yl)propan-2-one;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylimidazol-4-yl)ethanone;1-(1-methylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone

C168H163N39O8 — CID 157051338

IUPAC1-(1-cyclohexylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-(1-cyclopropylpyrazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[1-deuterio-6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylpyrazol-4-yl)ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[1-(2-methylpropyl)pyrrol-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-methylpyrazol-3-yl)ethanone;1-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-3-(1-methylpyrazol-4-yl)propan-2-one;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylimidazol-4-yl)ethanone;1-(1-methylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone
SMILESCC(C)Cn1ccc(C(=O)Cc2cc3cc(-c4cncn4C)ccc3cn2)c1.CC(C)n1cnc(C(=O)Cc2cc3cc(-c4cncn4C)ccc3cn2)c1.Cn1cc(CC(=O)Cc2cc3cc(-c4cncn4C)ccc3cn2)cn1.Cn1ccc(C(=O)Cc2cc3cc(-c4cncn4C)ccc3cn2)n1.Cn1cnc(C(=O)Cc2cc3cc(-c4cncn4C)ccc3cn2)c1.Cn1cncc1-c1ccc2cnc(CC(=O)c3cn(C4CCCCC4)cn3)cc2c1.Cn1cncc1-c1ccc2cnc(CC(=O)c3cnn(C4CC4)c3)cc2c1.[2H]c1nc(CC(=O)c2cnn(C(C)C)c2)cc2cc(-c3cncn3C)ccc12
InChIInChI=1S/C24H25N5O.C23H24N4O.C21H19N5O.2C21H21N5O.C20H19N5O.2C19H17N5O/c1-28-15-25-13-23(28)17-7-8-18-12-26-20(10-19(18)9-17)11-24(30)22-14-29(16-27-22)21-5-3-2-4-6-21;1-16(2)13-27-7-6-19(14-27)23(28)10-21-9-20-8-17(4-5-18(20)11-25-21)22-12-24-15-26(22)3;1-25-13-22-11-20(25)14-2-3-15-9-23-18(7-16(15)6-14)8-21(27)17-10-24-26(12-17)19-4-5-19;1-14(2)26-12-18(10-24-26)21(27)8-19-7-17-6-15(4-5-16(17)9-23-19)20-11-22-13-25(20)3;1-14(2)26-11-19(24-13-26)21(27)8-18-7-17-6-15(4-5-16(17)9-23-18)20-10-22-12-25(20)3;1-24-13-21-11-20(24)15-3-4-16-10-22-18(7-17(16)6-15)8-19(26)5-14-9-23-25(2)12-14;1-23-10-17(22-12-23)19(25)7-16-6-15-5-13(3-4-14(15)8-21-16)18-9-20-11-24(18)2;1-23-12-20-11-18(23)13-3-4-14-10-21-16(8-15(14)7-13)9-19(25)17-5-6-24(2)22-17/h7-10,12-16,21H,2-6,11H2,1H3;4-9,11-12,14-16H,10,13H2,1-3H3;2-3,6-7,9-13,19H,4-5,8H2,1H3;2*4-7,9-14H,8H2,1-3H3;3-4,6-7,9-13H,5,8H2,1-2H3;3-6,8-12H,7H2,1-2H3;3-8,10-12H,9H2,1-2H3/i;;;9D;;;;
InChIKeyAAFYKTRUAJRWMQ-OLHGYIBMSA-N
MW2857.42 g/mol
LogP28.86
Rot. Bonds39

About 1-(1-cyclohexylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-(1-cyclopropylpyrazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[1-deuterio-6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylpyrazol-4-yl)ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[1-(2-methylpropyl)pyrrol-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-methylpyrazol-3-yl)ethanone;1-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-3-(1-methylpyrazol-4-yl)propan-2-one;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylimidazol-4-yl)ethanone;1-(1-methylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone

1-(1-cyclohexylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-(1-cyclopropylpyrazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[1-deuterio-6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylpyrazol-4-yl)ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[1-(2-methylpropyl)pyrrol-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-methylpyrazol-3-yl)ethanone;1-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-3-(1-methylpyrazol-4-yl)propan-2-one;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylimidazol-4-yl)ethanone;1-(1-methylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone (PubChem CID 157051338) has the molecular formula C168H163N39O8 and a molecular weight of 2857.42 g/mol. Its IUPAC name is 1-(1-cyclohexylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-(1-cyclopropylpyrazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[1-deuterio-6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylpyrazol-4-yl)ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[1-(2-methylpropyl)pyrrol-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-methylpyrazol-3-yl)ethanone;1-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-3-(1-methylpyrazol-4-yl)propan-2-one;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylimidazol-4-yl)ethanone;1-(1-methylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone.

Molecular Properties

Compound Name1-(1-cyclohexylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-(1-cyclopropylpyrazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[1-deuterio-6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylpyrazol-4-yl)ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[1-(2-methylpropyl)pyrrol-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-methylpyrazol-3-yl)ethanone;1-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-3-(1-methylpyrazol-4-yl)propan-2-one;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylimidazol-4-yl)ethanone;1-(1-methylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone
PubChem CID157051338
Molecular FormulaC168H163N39O8
Molecular Weight2857.42 g/mol
Exact Mass2855.36
IUPAC Name1-(1-cyclohexylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-(1-cyclopropylpyrazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[1-deuterio-6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylpyrazol-4-yl)ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[1-(2-methylpropyl)pyrrol-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-methylpyrazol-3-yl)ethanone;1-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-3-(1-methylpyrazol-4-yl)propan-2-one;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylimidazol-4-yl)ethanone;1-(1-methylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone
SMILESCC(C)Cn1ccc(C(=O)Cc2cc3cc(-c4cncn4C)ccc3cn2)c1.CC(C)n1cnc(C(=O)Cc2cc3cc(-c4cncn4C)ccc3cn2)c1.Cn1cc(CC(=O)Cc2cc3cc(-c4cncn4C)ccc3cn2)cn1.Cn1ccc(C(=O)Cc2cc3cc(-c4cncn4C)ccc3cn2)n1.Cn1cnc(C(=O)Cc2cc3cc(-c4cncn4C)ccc3cn2)c1.Cn1cncc1-c1ccc2cnc(CC(=O)c3cn(C4CCCCC4)cn3)cc2c1.Cn1cncc1-c1ccc2cnc(CC(=O)c3cnn(C4CC4)c3)cc2c1.[2H]c1nc(CC(=O)c2cnn(C(C)C)c2)cc2cc(-c3cncn3C)ccc12
InChIInChI=1S/C24H25N5O.C23H24N4O.C21H19N5O.2C21H21N5O.C20H19N5O.2C19H17N5O/c1-28-15-25-13-23(28)17-7-8-18-12-26-20(10-19(18)9-17)11-24(30)22-14-29(16-27-22)21-5-3-2-4-6-21;1-16(2)13-27-7-6-19(14-27)23(28)10-21-9-20-8-17(4-5-18(20)11-25-21)22-12-24-15-26(22)3;1-25-13-22-11-20(25)14-2-3-15-9-23-18(7-16(15)6-14)8-21(27)17-10-24-26(12-17)19-4-5-19;1-14(2)26-12-18(10-24-26)21(27)8-19-7-17-6-15(4-5-16(17)9-23-19)20-11-22-13-25(20)3;1-14(2)26-11-19(24-13-26)21(27)8-18-7-17-6-15(4-5-16(17)9-23-18)20-10-22-12-25(20)3;1-24-13-21-11-20(24)15-3-4-16-10-22-18(7-17(16)6-15)8-19(26)5-14-9-23-25(2)12-14;1-23-10-17(22-12-23)19(25)7-16-6-15-5-13(3-4-14(15)8-21-16)18-9-20-11-24(18)2;1-23-12-20-11-18(23)13-3-4-14-10-21-16(8-15(14)7-13)9-19(25)17-5-6-24(2)22-17/h7-10,12-16,21H,2-6,11H2,1H3;4-9,11-12,14-16H,10,13H2,1-3H3;2-3,6-7,9-13,19H,4-5,8H2,1H3;2*4-7,9-14H,8H2,1-3H3;3-4,6-7,9-13H,5,8H2,1-2H3;3-6,8-12H,7H2,1-2H3;3-8,10-12H,9H2,1-2H3/i;;;9D;;;;
InChIKeyAAFYKTRUAJRWMQ-OLHGYIBMSA-N
XLogP28.86
TPSA511.91 Ų
H-Bond Donors
H-Bond Acceptors47
Rotatable Bonds39
Heavy Atoms215
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002857.42
LogP ≤ 528.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1047

Analyze 1-(1-cyclohexylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-(1-cyclopropylpyrazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[1-deuterio-6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylpyrazol-4-yl)ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[1-(2-methylpropyl)pyrrol-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-methylpyrazol-3-yl)ethanone;1-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-3-(1-methylpyrazol-4-yl)propan-2-one;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylimidazol-4-yl)ethanone;1-(1-methylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4,5-Dimethyl-3-pyrimidin-2-yl-2-pyridinyl)-[2-[[3-fluoro-5-(trifluoromethyl)-2-pyridinyl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone;(3-fluoro-6-methyl-2-pyrimidin-2-ylphenyl)-[2-[[3-fluoro-5-(trifluoromethyl)-2-pyridinyl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone;[3-fluoro-4-methyl-2-(triazol-2-yl)phenyl]-[2-[[3-fluoro-5-(trifluoromethyl)-2-pyridinyl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone
CID 157367142
1-[1-(2,2-Dimethylpropyl)-6-fluoro-5-(2-methylpyrimidin-5-yl)indazol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-2-fluoro-5-(2-methylpyrimidin-5-yl)indol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-6-fluoro-5-(2-methylpyrimidin-5-yl)indol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-2-methyl-5-(2-methylpyrimidin-5-yl)indol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-5-(2-methylpyrimidin-5-yl)pyrazolo[3,4-c]pyridin-3-yl]-2,2,2-trifluoroethanone
CID 157553292
(4R)-4-[3-(3-acetyl-4-fluorophenyl)-2-pyridinyl]-1-[4-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-5-(3,5-difluorophenyl)pentan-2-one;(4R)-4-[3-(3-acetyl-4-fluorophenyl)-2-pyridinyl]-5-(3,5-difluorophenyl)-1-[3-(trifluoromethyl)spiro[6,7-dihydro-5H-indazole-4,1'-cyclopropane]-1-yl]pentan-2-one;(4R)-4-[3-(3-acetylphenyl)-2-pyridinyl]-5-(3,5-difluorophenyl)-1-(5,6-dimethylbenzimidazol-1-yl)pentan-2-one;(4S)-5-(3,5-difluorophenyl)-1-(5,6-dimethylbenzimidazol-1-yl)-4-[5-(4-methylphenyl)pyrimidin-4-yl]pentan-2-one
CID 157667733
1-[(4R)-4-[3-(3-acetyl-4-fluorophenyl)-2-pyridinyl]-5-(3,5-difluorophenyl)-2-oxopentyl]-4-cyclopropylpyrazole-3-carbonitrile;1-[(4R)-4-[3-(3-acetyl-4-fluorophenyl)-2-pyridinyl]-5-(3,5-difluorophenyl)-2-oxopentyl]-7,7-difluoro-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;1-[(4R)-4-[3-(3-acetyl-4-fluorophenyl)-2-pyridinyl]-5-(3,5-difluorophenyl)-2-oxopentyl]-5H-imidazo[4,5-c]pyridin-4-one;(4R)-4-[3-(3-acetyl-4-fluorophenyl)-2-pyridinyl]-5-(3,5-difluorophenyl)-1-[3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]pentan-2-one;7-[(4R)-4-[3-(3-acetylphenyl)-2-pyridinyl]-5-(3,5-difluorophenyl)-2-oxopentyl]-3-cyclopropyl-1,5-dihydrocyclopenta[b]pyridin-2-one
CID 157746515
1-[1-(2,2-Dimethylpropyl)-7-methyl-5-(2-methylpyrimidin-5-yl)indazol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-7-methyl-5-(2-methylpyrimidin-5-yl)pyrrolo[2,3-c]pyridin-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-5-(2-methylpyrimidin-5-yl)indazol-3-yl]-2,2,2-trifluoroethanone;1-[1-(2,2-dimethylpropyl)-5-(2-methylpyrimidin-5-yl)indol-3-yl]-2,2,2-trifluoroethanone;1-[1-(2,2-dimethylpropyl)-5-(2-methylpyrimidin-5-yl)pyrrolo[2,3-c]pyridin-3-yl]-2,2,2-trifluoroethanone
CID 157925707
[2-Deuterio-2-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]-(3-fluoro-2-pyrimidin-2-ylphenyl)methanone;[2-(5-fluoropyrimidin-2-yl)phenyl]-[2-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone;[4-methyl-3-(triazol-2-yl)-2-pyridinyl]-[2-[[5-(trifluoromethyl)-2-pyridinyl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone
CID 157927933
1-[1-(2,2-Dimethylpropyl)-6-fluoro-5-(2-methylpyrimidin-5-yl)indazol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-2-fluoro-5-(2-methylpyrimidin-5-yl)indol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-6-fluoro-5-(2-methylpyrimidin-5-yl)indol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-2-methyl-5-(2-methylpyrimidin-5-yl)indol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-5-(2-methylpyrimidin-5-yl)indazol-3-yl]-2,2,2-trifluoroethanone;1-[1-(2,2-dimethylpropyl)-5-(2-methylpyrimidin-5-yl)pyrazolo[3,4-c]pyridin-3-yl]-2,2,2-trifluoroethanone
CID 157971119
5-[2-[(1S)-1-[[(2R)-2-(3-acetylindol-1-yl)butanoyl]amino]-2-(3,5-difluorophenyl)ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-1-[[(2S)-2-(3-acetylindol-1-yl)butanoyl]amino]-2-(3,5-difluorophenyl)ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[(2S)-2-(5,6-dimethylbenzimidazol-1-yl)-4,4,4-trifluorobutanoyl]amino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[(2R)-2-(5,6-dimethylbenzimidazol-1-yl)-4,4,4-trifluorobutanoyl]amino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[(2S)-2-[4-(trifluoromethyl)pyrazol-1-yl]butanoyl]amino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide
CID 157988375
5-[2-[(1S)-1-[[(2R)-2-(3-acetylindol-1-yl)butanoyl]amino]-2-(3,5-difluorophenyl)ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[(2S)-2-(5,6-dimethylbenzimidazol-1-yl)-4,4,4-trifluorobutanoyl]amino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[(2R)-2-(5,6-dimethylbenzimidazol-1-yl)-4,4,4-trifluorobutanoyl]amino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[(2R)-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]butanoyl]amino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[(2S)-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]butanoyl]amino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide
CID 158222114
(6-Methyl-3-pyrimidin-2-yl-2-pyridinyl)-[2-(quinoxalin-2-ylmethyl)-7-azabicyclo[2.2.1]heptan-7-yl]methanone;[2-(triazol-2-yl)phenyl]-[2-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone;[2-(triazol-2-yl)phenyl]-[2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone
CID 158316233
1-[1-(1-amino-4a,5-dihydroisoquinolin-7-yl)-3-(trifluoromethyl)pyrazol-5-yl]-2-[5-[1-amino-3-cyclopropyl-1-(4-methylphenyl)propyl]-2-fluorophenyl]ethanone;N-[5-[1-amino-1-(3-cyanophenyl)-3-cyclopropylpropyl]-2-fluorophenyl]-3-(1-aminoisoquinolin-7-yl)-1-methylimidazol-1-ium-4-carboxamide;2-[5-(1-amino-3-cyclopropyl-1-phenylpropyl)-2-fluorophenyl]-1-[2-(1-aminoisoquinolin-7-yl)-5-methylpyrazol-3-yl]ethanone;1-[2-(1-aminoisoquinolin-7-yl)-5-methylpyrazol-3-yl]-2-[5-[(cyclopropylmethylamino)-phenylmethyl]-2-fluorophenyl]ethanone
CID 158486095
(4,5-Dimethyl-3-pyrimidin-2-yl-2-pyridinyl)-[2-[[5-(trifluoromethyl)-2-pyridinyl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone;(3-fluoro-6-methyl-2-pyrimidin-2-ylphenyl)-[2-[[5-(trifluoromethyl)-2-pyridinyl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone;[3-fluoro-4-methyl-2-(triazol-2-yl)phenyl]-[2-[[5-(trifluoromethyl)-2-pyridinyl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone
CID 158965488

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclohexylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-(1-cyclopropylpyrazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[1-deuterio-6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylpyrazol-4-yl)ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[1-(2-methylpropyl)pyrrol-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-methylpyrazol-3-yl)ethanone;1-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-3-(1-methylpyrazol-4-yl)propan-2-one;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylimidazol-4-yl)ethanone;1-(1-methylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone?
The IUPAC name of 1-(1-cyclohexylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-(1-cyclopropylpyrazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[1-deuterio-6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylpyrazol-4-yl)ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[1-(2-methylpropyl)pyrrol-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-methylpyrazol-3-yl)ethanone;1-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-3-(1-methylpyrazol-4-yl)propan-2-one;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylimidazol-4-yl)ethanone;1-(1-methylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone (CID 157051338) is 1-(1-cyclohexylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-(1-cyclopropylpyrazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[1-deuterio-6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylpyrazol-4-yl)ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[1-(2-methylpropyl)pyrrol-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-methylpyrazol-3-yl)ethanone;1-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-3-(1-methylpyrazol-4-yl)propan-2-one;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylimidazol-4-yl)ethanone;1-(1-methylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone.
What is the SMILES notation for 1-(1-cyclohexylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-(1-cyclopropylpyrazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[1-deuterio-6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylpyrazol-4-yl)ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[1-(2-methylpropyl)pyrrol-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-methylpyrazol-3-yl)ethanone;1-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-3-(1-methylpyrazol-4-yl)propan-2-one;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylimidazol-4-yl)ethanone;1-(1-methylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone?
The canonical SMILES for 1-(1-cyclohexylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-(1-cyclopropylpyrazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[1-deuterio-6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylpyrazol-4-yl)ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[1-(2-methylpropyl)pyrrol-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-methylpyrazol-3-yl)ethanone;1-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-3-(1-methylpyrazol-4-yl)propan-2-one;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylimidazol-4-yl)ethanone;1-(1-methylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone is CC(C)Cn1ccc(C(=O)Cc2cc3cc(-c4cncn4C)ccc3cn2)c1.CC(C)n1cnc(C(=O)Cc2cc3cc(-c4cncn4C)ccc3cn2)c1.Cn1cc(CC(=O)Cc2cc3cc(-c4cncn4C)ccc3cn2)cn1.Cn1ccc(C(=O)Cc2cc3cc(-c4cncn4C)ccc3cn2)n1.Cn1cnc(C(=O)Cc2cc3cc(-c4cncn4C)ccc3cn2)c1.Cn1cncc1-c1ccc2cnc(CC(=O)c3cn(C4CCCCC4)cn3)cc2c1.Cn1cncc1-c1ccc2cnc(CC(=O)c3cnn(C4CC4)c3)cc2c1.[2H]c1nc(CC(=O)c2cnn(C(C)C)c2)cc2cc(-c3cncn3C)ccc12.
What is the InChIKey of 1-(1-cyclohexylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-(1-cyclopropylpyrazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[1-deuterio-6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylpyrazol-4-yl)ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[1-(2-methylpropyl)pyrrol-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-methylpyrazol-3-yl)ethanone;1-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-3-(1-methylpyrazol-4-yl)propan-2-one;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylimidazol-4-yl)ethanone;1-(1-methylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone?
The InChIKey is AAFYKTRUAJRWMQ-OLHGYIBMSA-N. The full InChI is InChI=1S/C24H25N5O.C23H24N4O.C21H19N5O.2C21H21N5O.C20H19N5O.2C19H17N5O/c1-28-15-25-13-23(28)17-7-8-18-12-26-20(10-19(18)9-17)11-24(30)22-14-29(16-27-22)21-5-3-2-4-6-21;1-16(2)13-27-7-6-19(14-27)23(28)10-21-9-20-8-17(4-5-18(20)11-25-21)22-12-24-15-26(22)3;1-25-13-22-11-20(25)14-2-3-15-9-23-18(7-16(15)6-14)8-21(27)17-10-24-26(12-17)19-4-5-19;1-14(2)26-12-18(10-24-26)21(27)8-19-7-17-6-15(4-5-16(17)9-23-19)20-11-22-13-25(20)3;1-14(2)26-11-19(24-13-26)21(27)8-18-7-17-6-15(4-5-16(17)9-23-18)20-10-22-12-25(20)3;1-24-13-21-11-20(24)15-3-4-16-10-22-18(7-17(16)6-15)8-19(26)5-14-9-23-25(2)12-14;1-23-10-17(22-12-23)19(25)7-16-6-15-5-13(3-4-14(15)8-21-16)18-9-20-11-24(18)2;1-23-12-20-11-18(23)13-3-4-14-10-21-16(8-15(14)7-13)9-19(25)17-5-6-24(2)22-17/h7-10,12-16,21H,2-6,11H2,1H3;4-9,11-12,14-16H,10,13H2,1-3H3;2-3,6-7,9-13,19H,4-5,8H2,1H3;2*4-7,9-14H,8H2,1-3H3;3-4,6-7,9-13H,5,8H2,1-2H3;3-6,8-12H,7H2,1-2H3;3-8,10-12H,9H2,1-2H3/i;;;9D;;;;.
What are the key properties of 1-(1-cyclohexylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-(1-cyclopropylpyrazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[1-deuterio-6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylpyrazol-4-yl)ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[1-(2-methylpropyl)pyrrol-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-methylpyrazol-3-yl)ethanone;1-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-3-(1-methylpyrazol-4-yl)propan-2-one;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylimidazol-4-yl)ethanone;1-(1-methylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone?
1-(1-cyclohexylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-(1-cyclopropylpyrazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[1-deuterio-6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylpyrazol-4-yl)ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[1-(2-methylpropyl)pyrrol-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-methylpyrazol-3-yl)ethanone;1-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-3-(1-methylpyrazol-4-yl)propan-2-one;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylimidazol-4-yl)ethanone;1-(1-methylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone has a molecular weight of 2857.42 g/mol, XLogP of 28.86, 39 rotatable bonds, 0 hydrogen bond donors, and 47 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclohexylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-(1-cyclopropylpyrazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[1-deuterio-6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylpyrazol-4-yl)ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[1-(2-methylpropyl)pyrrol-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-methylpyrazol-3-yl)ethanone;1-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-3-(1-methylpyrazol-4-yl)propan-2-one;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(1-propan-2-ylimidazol-4-yl)ethanone;1-(1-methylimidazol-4-yl)-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone is sourced from PubChem (CID 157051338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).