3-[6-(1-tert-butylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;3-[6-(1-cyclohexylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-3-[6-[1-(4,4-difluorocyclohexyl)imidazol-2-yl]-2-pyridinyl]-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-7-methyl-3-[6-[1-(oxan-4-yl)imidazol-2-yl]-2-pyridinyl]quinazolin-4-one;6-(4-ethylimidazol-1-yl)-7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-6-(4-phenylimidazol-1-yl)-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]-6-(6-propan-2-yl-3-pyridinyl)quinazolin-4-one

C195H188F2N48O8 — CID 159820545

IUPAC3-[6-(1-tert-butylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;3-[6-(1-cyclohexylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-3-[6-[1-(4,4-difluorocyclohexyl)imidazol-2-yl]-2-pyridinyl]-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-7-methyl-3-[6-[1-(oxan-4-yl)imidazol-2-yl]-2-pyridinyl]quinazolin-4-one;6-(4-ethylimidazol-1-yl)-7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-6-(4-phenylimidazol-1-yl)-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]-6-(6-propan-2-yl-3-pyridinyl)quinazolin-4-one
SMILESCCc1cn(-c2cc3c(=O)n(-c4cccc(-c5nccn5C(C)C)n4)cnc3cc2C)cn1.Cc1cc2ncn(-c3cccc(-c4nccn4C(C)(C)C)n3)c(=O)c2cc1-n1cnc(C2CC2)c1.Cc1cc2ncn(-c3cccc(-c4nccn4C(C)C)n3)c(=O)c2cc1-c1ccc(C(C)C)nc1.Cc1cc2ncn(-c3cccc(-c4nccn4C(C)C)n3)c(=O)c2cc1-n1cnc(-c2ccccc2)c1.Cc1cc2ncn(-c3cccc(-c4nccn4C4CCC(F)(F)CC4)n3)c(=O)c2cc1-n1cnc(C2CC2)c1.Cc1cc2ncn(-c3cccc(-c4nccn4C4CCCCC4)n3)c(=O)c2cc1-n1cnc(C2CC2)c1.Cc1cc2ncn(-c3cccc(-c4nccn4C4CCOCC4)n3)c(=O)c2cc1-n1cnc(C2CC2)c1
InChIInChI=1S/C29H27F2N7O.C29H29N7O.C29H25N7O.C28H27N7O2.C28H28N6O.C27H27N7O.C25H25N7O/c1-18-13-23-21(14-25(18)36-15-24(33-16-36)19-5-6-19)28(39)38(17-34-23)26-4-2-3-22(35-26)27-32-11-12-37(27)20-7-9-29(30,31)10-8-20;1-19-14-24-22(15-26(19)34-16-25(31-17-34)20-10-11-20)29(37)36(18-32-24)27-9-5-8-23(33-27)28-30-12-13-35(28)21-6-3-2-4-7-21;1-19(2)35-13-12-30-28(35)23-10-7-11-27(33-23)36-18-32-24-14-20(3)26(15-22(24)29(36)37)34-16-25(31-17-34)21-8-5-4-6-9-21;1-18-13-23-21(14-25(18)33-15-24(30-16-33)19-5-6-19)28(36)35(17-31-23)26-4-2-3-22(32-26)27-29-9-10-34(27)20-7-11-37-12-8-20;1-17(2)23-10-9-20(15-30-23)21-14-22-25(13-19(21)5)31-16-34(28(22)35)26-8-6-7-24(32-26)27-29-11-12-33(27)18(3)4;1-17-12-21-19(13-23(17)32-14-22(29-15-32)18-8-9-18)26(35)33(16-30-21)24-7-5-6-20(31-24)25-28-10-11-34(25)27(2,3)4;1-5-18-13-30(14-27-18)22-12-19-21(11-17(22)4)28-15-32(25(19)33)23-8-6-7-20(29-23)24-26-9-10-31(24)16(2)3/h2-4,11-17,19-20H,5-10H2,1H3;5,8-9,12-18,20-21H,2-4,6-7,10-11H2,1H3;4-19H,1-3H3;2-4,9-10,13-17,19-20H,5-8,11-12H2,1H3;6-18H,1-5H3;5-7,10-16,18H,8-9H2,1-4H3;6-16H,5H2,1-4H3
InChIKeyNMEHJSMAKPHYHM-UHFFFAOYSA-N
MW3369.97 g/mol
LogP35.81
Rot. Bonds34

About 3-[6-(1-tert-butylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;3-[6-(1-cyclohexylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-3-[6-[1-(4,4-difluorocyclohexyl)imidazol-2-yl]-2-pyridinyl]-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-7-methyl-3-[6-[1-(oxan-4-yl)imidazol-2-yl]-2-pyridinyl]quinazolin-4-one;6-(4-ethylimidazol-1-yl)-7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-6-(4-phenylimidazol-1-yl)-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]-6-(6-propan-2-yl-3-pyridinyl)quinazolin-4-one

3-[6-(1-tert-butylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;3-[6-(1-cyclohexylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-3-[6-[1-(4,4-difluorocyclohexyl)imidazol-2-yl]-2-pyridinyl]-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-7-methyl-3-[6-[1-(oxan-4-yl)imidazol-2-yl]-2-pyridinyl]quinazolin-4-one;6-(4-ethylimidazol-1-yl)-7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-6-(4-phenylimidazol-1-yl)-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]-6-(6-propan-2-yl-3-pyridinyl)quinazolin-4-one (PubChem CID 159820545) has the molecular formula C195H188F2N48O8 and a molecular weight of 3369.97 g/mol. Its IUPAC name is 3-[6-(1-tert-butylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;3-[6-(1-cyclohexylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-3-[6-[1-(4,4-difluorocyclohexyl)imidazol-2-yl]-2-pyridinyl]-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-7-methyl-3-[6-[1-(oxan-4-yl)imidazol-2-yl]-2-pyridinyl]quinazolin-4-one;6-(4-ethylimidazol-1-yl)-7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-6-(4-phenylimidazol-1-yl)-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]-6-(6-propan-2-yl-3-pyridinyl)quinazolin-4-one.

Molecular Properties

Compound Name3-[6-(1-tert-butylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;3-[6-(1-cyclohexylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-3-[6-[1-(4,4-difluorocyclohexyl)imidazol-2-yl]-2-pyridinyl]-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-7-methyl-3-[6-[1-(oxan-4-yl)imidazol-2-yl]-2-pyridinyl]quinazolin-4-one;6-(4-ethylimidazol-1-yl)-7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-6-(4-phenylimidazol-1-yl)-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]-6-(6-propan-2-yl-3-pyridinyl)quinazolin-4-one
PubChem CID159820545
Molecular FormulaC195H188F2N48O8
Molecular Weight3369.97 g/mol
Exact Mass3367.57
IUPAC Name3-[6-(1-tert-butylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;3-[6-(1-cyclohexylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-3-[6-[1-(4,4-difluorocyclohexyl)imidazol-2-yl]-2-pyridinyl]-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-7-methyl-3-[6-[1-(oxan-4-yl)imidazol-2-yl]-2-pyridinyl]quinazolin-4-one;6-(4-ethylimidazol-1-yl)-7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-6-(4-phenylimidazol-1-yl)-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]-6-(6-propan-2-yl-3-pyridinyl)quinazolin-4-one
SMILESCCc1cn(-c2cc3c(=O)n(-c4cccc(-c5nccn5C(C)C)n4)cnc3cc2C)cn1.Cc1cc2ncn(-c3cccc(-c4nccn4C(C)(C)C)n3)c(=O)c2cc1-n1cnc(C2CC2)c1.Cc1cc2ncn(-c3cccc(-c4nccn4C(C)C)n3)c(=O)c2cc1-c1ccc(C(C)C)nc1.Cc1cc2ncn(-c3cccc(-c4nccn4C(C)C)n3)c(=O)c2cc1-n1cnc(-c2ccccc2)c1.Cc1cc2ncn(-c3cccc(-c4nccn4C4CCC(F)(F)CC4)n3)c(=O)c2cc1-n1cnc(C2CC2)c1.Cc1cc2ncn(-c3cccc(-c4nccn4C4CCCCC4)n3)c(=O)c2cc1-n1cnc(C2CC2)c1.Cc1cc2ncn(-c3cccc(-c4nccn4C4CCOCC4)n3)c(=O)c2cc1-n1cnc(C2CC2)c1
InChIInChI=1S/C29H27F2N7O.C29H29N7O.C29H25N7O.C28H27N7O2.C28H28N6O.C27H27N7O.C25H25N7O/c1-18-13-23-21(14-25(18)36-15-24(33-16-36)19-5-6-19)28(39)38(17-34-23)26-4-2-3-22(35-26)27-32-11-12-37(27)20-7-9-29(30,31)10-8-20;1-19-14-24-22(15-26(19)34-16-25(31-17-34)20-10-11-20)29(37)36(18-32-24)27-9-5-8-23(33-27)28-30-12-13-35(28)21-6-3-2-4-7-21;1-19(2)35-13-12-30-28(35)23-10-7-11-27(33-23)36-18-32-24-14-20(3)26(15-22(24)29(36)37)34-16-25(31-17-34)21-8-5-4-6-9-21;1-18-13-23-21(14-25(18)33-15-24(30-16-33)19-5-6-19)28(36)35(17-31-23)26-4-2-3-22(32-26)27-29-9-10-34(27)20-7-11-37-12-8-20;1-17(2)23-10-9-20(15-30-23)21-14-22-25(13-19(21)5)31-16-34(28(22)35)26-8-6-7-24(32-26)27-29-11-12-33(27)18(3)4;1-17-12-21-19(13-23(17)32-14-22(29-15-32)18-8-9-18)26(35)33(16-30-21)24-7-5-6-20(31-24)25-28-10-11-34(25)27(2,3)4;1-5-18-13-30(14-27-18)22-12-19-21(11-17(22)4)28-15-32(25(19)33)23-8-6-7-20(29-23)24-26-9-10-31(24)16(2)3/h2-4,11-17,19-20H,5-10H2,1H3;5,8-9,12-18,20-21H,2-4,6-7,10-11H2,1H3;4-19H,1-3H3;2-4,9-10,13-17,19-20H,5-8,11-12H2,1H3;6-18H,1-5H3;5-7,10-16,18H,8-9H2,1-4H3;6-16H,5H2,1-4H3
InChIKeyNMEHJSMAKPHYHM-UHFFFAOYSA-N
XLogP35.81
TPSA588.24 Ų
H-Bond Donors
H-Bond Acceptors56
Rotatable Bonds34
Heavy Atoms253
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003369.97
LogP ≤ 535.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1056

Analyze 3-[6-(1-tert-butylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;3-[6-(1-cyclohexylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-3-[6-[1-(4,4-difluorocyclohexyl)imidazol-2-yl]-2-pyridinyl]-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-7-methyl-3-[6-[1-(oxan-4-yl)imidazol-2-yl]-2-pyridinyl]quinazolin-4-one;6-(4-ethylimidazol-1-yl)-7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-6-(4-phenylimidazol-1-yl)-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]-6-(6-propan-2-yl-3-pyridinyl)quinazolin-4-one with MolForge

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Launch Full Analysis

Related Compounds

(3-Fluoro-4-methyl-2-pyrimidin-2-ylphenyl)-[2-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone;(3-fluoro-4-methyl-2-pyrimidin-2-ylphenyl)-[2-[[5-(trifluoromethyl)-2-pyridinyl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone;(3-fluoro-5-methyl-2-pyrimidin-2-ylphenyl)-[2-[[5-(trifluoromethyl)-2-pyridinyl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone
CID 157287011
(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
N-(2-methoxyethyl)-N-methyl-4-[[5-(1-methylidene-2,3-dihydroisoindol-5-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-[8-[4-(4-propan-2-ylpiperazin-1-yl)-3-(trifluoromethyl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one;5-[8-[4-(1-propan-2-ylpiperidin-4-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-2,3-dihydroisoindol-1-one
CID 158117159
7-[[6-[[2,2-difluoroethyl(methyl)amino]methyl]-5-[(3S)-oxolan-3-yl]-2-pyridinyl]amino]-4-(7-fluoroimidazo[1,2-a]pyridin-3-yl)-2,3-dihydroisoindol-1-one;4-(7-fluoroimidazo[1,2-a]pyridin-3-yl)-7-[[5-[(3R)-oxolan-3-yl]-6-(4,4,4-trifluorobutyl)-2-pyridinyl]amino]-2,3-dihydroisoindol-1-one;4-(7-fluoroimidazo[1,2-a]pyridin-3-yl)-7-[[5-[(3S)-oxolan-3-yl]-6-(4,4,4-trifluorobutyl)-2-pyridinyl]amino]-2,3-dihydroisoindol-1-one
CID 158304032
5-(3,3-dimethyl-2-oxo-1-pyrazin-2-ylindol-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyridin-3-ylindol-4-yl)-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-(3,3-dimethyl-2-oxo-1-pyridin-3-ylindol-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)pyridine-3-carboxamide;5-(3,3-dimethyl-2-oxo-1-pyrimidin-2-ylindol-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide
CID 158766362
[3-Fluoro-2-(5-fluoropyrimidin-2-yl)phenyl]-[2-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone;[2-(5-fluoropyrimidin-2-yl)-3-methylphenyl]-[2-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone;(2-pyrimidin-2-ylphenyl)-[2-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone
CID 158813822
4-[7-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-7-[[6-[(dimethylamino)methyl]-5-[(3R)-oxolan-3-yl]-2-pyridinyl]amino]-2,3-dihydroisoindol-1-one;4-[7-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-7-[[6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]-2-pyridinyl]amino]-2,3-dihydroisoindol-1-one;4-(7-fluoroimidazo[1,2-a]pyridin-3-yl)-7-[[6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-5-[(3R)-oxolan-3-yl]-2-pyridinyl]amino]-2,3-dihydroisoindol-1-one
CID 158855002
(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
(3-Fluoro-2-pyrimidin-2-ylphenyl)-[2-[methyl-[5-(trifluoromethyl)pyrazin-2-yl]amino]-7-azabicyclo[2.2.1]heptan-7-yl]methanone;(4-fluoro-2-pyrimidin-2-ylphenyl)-[2-[[5-(trifluoromethyl)-2-pyridinyl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone;(3-methyl-2-pyrimidin-2-ylphenyl)-[2-[[5-(trifluoromethyl)pyrimidin-2-yl]methyl]-7-azabicyclo[2.2.1]heptan-7-yl]methanone
CID 158999512
5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylindol-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyrimidin-4-ylindol-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;5-(3,3-dimethyl-2-oxo-1-pyrimidin-2-ylindol-4-yl)-N-(4-methylphenyl)-2-(trifluoromethyl)pyridine-3-carboxamide;5-[3,3-dimethyl-2-oxo-1-(pyrimidin-2-ylmethyl)indol-4-yl]-2-methyl-N-(4-methylphenyl)benzamide
CID 159160449
6-(4-cyclopropylimidazol-1-yl)-2-[6-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-yl)-2-pyridinyl]-5-methyl-3H-isoindol-1-one;6-(4-cyclopropylimidazol-1-yl)-5-methyl-2-(6-spiro[6,7-dihydropyrrolo[2,1-c][1,2,4]triazole-5,1'-cyclopropane]-3-yl-2-pyridinyl)-3H-isoindol-1-one;6-(4-cyclopropylimidazol-1-yl)-5-methyl-2-[6-[(5S)-5-(trifluoromethyl)-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-3-yl]-2-pyridinyl]-3H-isoindol-1-one
CID 159202747
8-butan-2-yl-2-[4-(piperidin-4-ylamino)anilino]-6-(5-pyrrolidin-3-yl-2-pyridinyl)pyrido[2,3-d]pyrimidin-7-one;6-(2-cyclopentylphenyl)-2-(3-methyl-4-piperazin-1-ylanilino)-8-(2-oxo-2-pyrrolidin-1-ylethyl)pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-8-(oxan-4-ylmethyl)-6-[1-(4H-pyrazol-3-yl)-2,3-dihydropyrrol-5-yl]pyrido[2,3-d]pyrimidin-7-one;2-[4-[(1-methylpyrrolidin-3-yl)amino]anilino]-6-[2-(oxolan-3-yl)pyrimidin-5-yl]-8-[[2-(trifluoromethyl)phenyl]methyl]pyrido[2,3-d]pyrimidin-7-one;8-(2-morpholin-4-ylethyl)-2-[4-(piperidin-3-ylamino)anilino]-6-(4-pyrrolidin-2-ylphenyl)pyrido[2,3-d]pyrimidin-7-one;dihydrate
CID 159217137

Frequently Asked Questions

What is the IUPAC name of 3-[6-(1-tert-butylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;3-[6-(1-cyclohexylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-3-[6-[1-(4,4-difluorocyclohexyl)imidazol-2-yl]-2-pyridinyl]-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-7-methyl-3-[6-[1-(oxan-4-yl)imidazol-2-yl]-2-pyridinyl]quinazolin-4-one;6-(4-ethylimidazol-1-yl)-7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-6-(4-phenylimidazol-1-yl)-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]-6-(6-propan-2-yl-3-pyridinyl)quinazolin-4-one?
The IUPAC name of 3-[6-(1-tert-butylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;3-[6-(1-cyclohexylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-3-[6-[1-(4,4-difluorocyclohexyl)imidazol-2-yl]-2-pyridinyl]-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-7-methyl-3-[6-[1-(oxan-4-yl)imidazol-2-yl]-2-pyridinyl]quinazolin-4-one;6-(4-ethylimidazol-1-yl)-7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-6-(4-phenylimidazol-1-yl)-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]-6-(6-propan-2-yl-3-pyridinyl)quinazolin-4-one (CID 159820545) is 3-[6-(1-tert-butylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;3-[6-(1-cyclohexylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-3-[6-[1-(4,4-difluorocyclohexyl)imidazol-2-yl]-2-pyridinyl]-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-7-methyl-3-[6-[1-(oxan-4-yl)imidazol-2-yl]-2-pyridinyl]quinazolin-4-one;6-(4-ethylimidazol-1-yl)-7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-6-(4-phenylimidazol-1-yl)-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]-6-(6-propan-2-yl-3-pyridinyl)quinazolin-4-one.
What is the SMILES notation for 3-[6-(1-tert-butylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;3-[6-(1-cyclohexylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-3-[6-[1-(4,4-difluorocyclohexyl)imidazol-2-yl]-2-pyridinyl]-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-7-methyl-3-[6-[1-(oxan-4-yl)imidazol-2-yl]-2-pyridinyl]quinazolin-4-one;6-(4-ethylimidazol-1-yl)-7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-6-(4-phenylimidazol-1-yl)-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]-6-(6-propan-2-yl-3-pyridinyl)quinazolin-4-one?
The canonical SMILES for 3-[6-(1-tert-butylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;3-[6-(1-cyclohexylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-3-[6-[1-(4,4-difluorocyclohexyl)imidazol-2-yl]-2-pyridinyl]-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-7-methyl-3-[6-[1-(oxan-4-yl)imidazol-2-yl]-2-pyridinyl]quinazolin-4-one;6-(4-ethylimidazol-1-yl)-7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-6-(4-phenylimidazol-1-yl)-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]-6-(6-propan-2-yl-3-pyridinyl)quinazolin-4-one is CCc1cn(-c2cc3c(=O)n(-c4cccc(-c5nccn5C(C)C)n4)cnc3cc2C)cn1.Cc1cc2ncn(-c3cccc(-c4nccn4C(C)(C)C)n3)c(=O)c2cc1-n1cnc(C2CC2)c1.Cc1cc2ncn(-c3cccc(-c4nccn4C(C)C)n3)c(=O)c2cc1-c1ccc(C(C)C)nc1.Cc1cc2ncn(-c3cccc(-c4nccn4C(C)C)n3)c(=O)c2cc1-n1cnc(-c2ccccc2)c1.Cc1cc2ncn(-c3cccc(-c4nccn4C4CCC(F)(F)CC4)n3)c(=O)c2cc1-n1cnc(C2CC2)c1.Cc1cc2ncn(-c3cccc(-c4nccn4C4CCCCC4)n3)c(=O)c2cc1-n1cnc(C2CC2)c1.Cc1cc2ncn(-c3cccc(-c4nccn4C4CCOCC4)n3)c(=O)c2cc1-n1cnc(C2CC2)c1.
What is the InChIKey of 3-[6-(1-tert-butylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;3-[6-(1-cyclohexylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-3-[6-[1-(4,4-difluorocyclohexyl)imidazol-2-yl]-2-pyridinyl]-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-7-methyl-3-[6-[1-(oxan-4-yl)imidazol-2-yl]-2-pyridinyl]quinazolin-4-one;6-(4-ethylimidazol-1-yl)-7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-6-(4-phenylimidazol-1-yl)-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]-6-(6-propan-2-yl-3-pyridinyl)quinazolin-4-one?
The InChIKey is NMEHJSMAKPHYHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H27F2N7O.C29H29N7O.C29H25N7O.C28H27N7O2.C28H28N6O.C27H27N7O.C25H25N7O/c1-18-13-23-21(14-25(18)36-15-24(33-16-36)19-5-6-19)28(39)38(17-34-23)26-4-2-3-22(35-26)27-32-11-12-37(27)20-7-9-29(30,31)10-8-20;1-19-14-24-22(15-26(19)34-16-25(31-17-34)20-10-11-20)29(37)36(18-32-24)27-9-5-8-23(33-27)28-30-12-13-35(28)21-6-3-2-4-7-21;1-19(2)35-13-12-30-28(35)23-10-7-11-27(33-23)36-18-32-24-14-20(3)26(15-22(24)29(36)37)34-16-25(31-17-34)21-8-5-4-6-9-21;1-18-13-23-21(14-25(18)33-15-24(30-16-33)19-5-6-19)28(36)35(17-31-23)26-4-2-3-22(32-26)27-29-9-10-34(27)20-7-11-37-12-8-20;1-17(2)23-10-9-20(15-30-23)21-14-22-25(13-19(21)5)31-16-34(28(22)35)26-8-6-7-24(32-26)27-29-11-12-33(27)18(3)4;1-17-12-21-19(13-23(17)32-14-22(29-15-32)18-8-9-18)26(35)33(16-30-21)24-7-5-6-20(31-24)25-28-10-11-34(25)27(2,3)4;1-5-18-13-30(14-27-18)22-12-19-21(11-17(22)4)28-15-32(25(19)33)23-8-6-7-20(29-23)24-26-9-10-31(24)16(2)3/h2-4,11-17,19-20H,5-10H2,1H3;5,8-9,12-18,20-21H,2-4,6-7,10-11H2,1H3;4-19H,1-3H3;2-4,9-10,13-17,19-20H,5-8,11-12H2,1H3;6-18H,1-5H3;5-7,10-16,18H,8-9H2,1-4H3;6-16H,5H2,1-4H3.
What are the key properties of 3-[6-(1-tert-butylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;3-[6-(1-cyclohexylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-3-[6-[1-(4,4-difluorocyclohexyl)imidazol-2-yl]-2-pyridinyl]-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-7-methyl-3-[6-[1-(oxan-4-yl)imidazol-2-yl]-2-pyridinyl]quinazolin-4-one;6-(4-ethylimidazol-1-yl)-7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-6-(4-phenylimidazol-1-yl)-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]-6-(6-propan-2-yl-3-pyridinyl)quinazolin-4-one?
3-[6-(1-tert-butylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;3-[6-(1-cyclohexylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-3-[6-[1-(4,4-difluorocyclohexyl)imidazol-2-yl]-2-pyridinyl]-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-7-methyl-3-[6-[1-(oxan-4-yl)imidazol-2-yl]-2-pyridinyl]quinazolin-4-one;6-(4-ethylimidazol-1-yl)-7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-6-(4-phenylimidazol-1-yl)-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]-6-(6-propan-2-yl-3-pyridinyl)quinazolin-4-one has a molecular weight of 3369.97 g/mol, XLogP of 35.81, 34 rotatable bonds, 0 hydrogen bond donors, and 56 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-(1-tert-butylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;3-[6-(1-cyclohexylimidazol-2-yl)-2-pyridinyl]-6-(4-cyclopropylimidazol-1-yl)-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-3-[6-[1-(4,4-difluorocyclohexyl)imidazol-2-yl]-2-pyridinyl]-7-methylquinazolin-4-one;6-(4-cyclopropylimidazol-1-yl)-7-methyl-3-[6-[1-(oxan-4-yl)imidazol-2-yl]-2-pyridinyl]quinazolin-4-one;6-(4-ethylimidazol-1-yl)-7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-6-(4-phenylimidazol-1-yl)-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]quinazolin-4-one;7-methyl-3-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]-6-(6-propan-2-yl-3-pyridinyl)quinazolin-4-one is sourced from PubChem (CID 159820545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).