[4-(2,3-dimethylimidazol-4-yl)-2-phenylquinazolin-7-yl]-piperidin-1-ylmethanone;(2,4-diphenylquinazolin-7-yl)-piperidin-1-ylmethanone;(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone;2-phenyl-7-(piperidine-1-carbonyl)-3H-quinazolin-4-one;(2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone

C112H107N17O6 — CID 159610585

IUPAC[4-(2,3-dimethylimidazol-4-yl)-2-phenylquinazolin-7-yl]-piperidin-1-ylmethanone;(2,4-diphenylquinazolin-7-yl)-piperidin-1-ylmethanone;(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone;2-phenyl-7-(piperidine-1-carbonyl)-3H-quinazolin-4-one;(2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone
SMILESCc1nc(-c2ccccc2)nc2cc(C(=O)N3CCCCC3)ccc12.Cc1ncc(-c2nc(-c3ccccc3)nc3cc(C(=O)N4CCCCC4)ccc23)n1C.O=C(c1ccc2c(-c3ccccc3)nc(-c3ccccc3)nc2c1)N1CCCCC1.O=C(c1ccc2c(=O)[nH]c(-c3ccccc3)nc2c1)N1CCCCC1.O=C(c1ccc2cnc(-c3ccccc3)nc2c1)N1CCCCC1
InChIInChI=1S/C26H23N3O.C25H25N5O.C21H21N3O.C20H19N3O2.C20H19N3O/c30-26(29-16-8-3-9-17-29)21-14-15-22-23(18-21)27-25(20-12-6-2-7-13-20)28-24(22)19-10-4-1-5-11-19;1-17-26-16-22(29(17)2)23-20-12-11-19(25(31)30-13-7-4-8-14-30)15-21(20)27-24(28-23)18-9-5-3-6-10-18;1-15-18-11-10-17(21(25)24-12-6-3-7-13-24)14-19(18)23-20(22-15)16-8-4-2-5-9-16;24-19-16-10-9-15(20(25)23-11-5-2-6-12-23)13-17(16)21-18(22-19)14-7-3-1-4-8-14;24-20(23-11-5-2-6-12-23)16-9-10-17-14-21-19(22-18(17)13-16)15-7-3-1-4-8-15/h1-2,4-7,10-15,18H,3,8-9,16-17H2;3,5-6,9-12,15-16H,4,7-8,13-14H2,1-2H3;2,4-5,8-11,14H,3,6-7,12-13H2,1H3;1,3-4,7-10,13H,2,5-6,11-12H2,(H,21,22,24);1,3-4,7-10,13-14H,2,5-6,11-12H2
InChIKeyMMQIQRZLKZCRSE-UHFFFAOYSA-N
MW1787.20 g/mol
LogP21.59
Rot. Bonds12

About [4-(2,3-dimethylimidazol-4-yl)-2-phenylquinazolin-7-yl]-piperidin-1-ylmethanone;(2,4-diphenylquinazolin-7-yl)-piperidin-1-ylmethanone;(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone;2-phenyl-7-(piperidine-1-carbonyl)-3H-quinazolin-4-one;(2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone

[4-(2,3-dimethylimidazol-4-yl)-2-phenylquinazolin-7-yl]-piperidin-1-ylmethanone;(2,4-diphenylquinazolin-7-yl)-piperidin-1-ylmethanone;(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone;2-phenyl-7-(piperidine-1-carbonyl)-3H-quinazolin-4-one;(2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone (PubChem CID 159610585) has the molecular formula C112H107N17O6 and a molecular weight of 1787.20 g/mol. Its IUPAC name is [4-(2,3-dimethylimidazol-4-yl)-2-phenylquinazolin-7-yl]-piperidin-1-ylmethanone;(2,4-diphenylquinazolin-7-yl)-piperidin-1-ylmethanone;(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone;2-phenyl-7-(piperidine-1-carbonyl)-3H-quinazolin-4-one;(2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name[4-(2,3-dimethylimidazol-4-yl)-2-phenylquinazolin-7-yl]-piperidin-1-ylmethanone;(2,4-diphenylquinazolin-7-yl)-piperidin-1-ylmethanone;(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone;2-phenyl-7-(piperidine-1-carbonyl)-3H-quinazolin-4-one;(2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone
PubChem CID159610585
Molecular FormulaC112H107N17O6
Molecular Weight1787.20 g/mol
Exact Mass1785.86
IUPAC Name[4-(2,3-dimethylimidazol-4-yl)-2-phenylquinazolin-7-yl]-piperidin-1-ylmethanone;(2,4-diphenylquinazolin-7-yl)-piperidin-1-ylmethanone;(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone;2-phenyl-7-(piperidine-1-carbonyl)-3H-quinazolin-4-one;(2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone
SMILESCc1nc(-c2ccccc2)nc2cc(C(=O)N3CCCCC3)ccc12.Cc1ncc(-c2nc(-c3ccccc3)nc3cc(C(=O)N4CCCCC4)ccc23)n1C.O=C(c1ccc2c(-c3ccccc3)nc(-c3ccccc3)nc2c1)N1CCCCC1.O=C(c1ccc2c(=O)[nH]c(-c3ccccc3)nc2c1)N1CCCCC1.O=C(c1ccc2cnc(-c3ccccc3)nc2c1)N1CCCCC1
InChIInChI=1S/C26H23N3O.C25H25N5O.C21H21N3O.C20H19N3O2.C20H19N3O/c30-26(29-16-8-3-9-17-29)21-14-15-22-23(18-21)27-25(20-12-6-2-7-13-20)28-24(22)19-10-4-1-5-11-19;1-17-26-16-22(29(17)2)23-20-12-11-19(25(31)30-13-7-4-8-14-30)15-21(20)27-24(28-23)18-9-5-3-6-10-18;1-15-18-11-10-17(21(25)24-12-6-3-7-13-24)14-19(18)23-20(22-15)16-8-4-2-5-9-16;24-19-16-10-9-15(20(25)23-11-5-2-6-12-23)13-17(16)21-18(22-19)14-7-3-1-4-8-14;24-20(23-11-5-2-6-12-23)16-9-10-17-14-21-19(22-18(17)13-16)15-7-3-1-4-8-15/h1-2,4-7,10-15,18H,3,8-9,16-17H2;3,5-6,9-12,15-16H,4,7-8,13-14H2,1-2H3;2,4-5,8-11,14H,3,6-7,12-13H2,1H3;1,3-4,7-10,13H,2,5-6,11-12H2,(H,21,22,24);1,3-4,7-10,13-14H,2,5-6,11-12H2
InChIKeyMMQIQRZLKZCRSE-UHFFFAOYSA-N
XLogP21.59
TPSA268.24 Ų
H-Bond Donors1
H-Bond Acceptors17
Rotatable Bonds12
Heavy Atoms135
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001787.20
LogP ≤ 521.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1017

Analyze [4-(2,3-dimethylimidazol-4-yl)-2-phenylquinazolin-7-yl]-piperidin-1-ylmethanone;(2,4-diphenylquinazolin-7-yl)-piperidin-1-ylmethanone;(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone;2-phenyl-7-(piperidine-1-carbonyl)-3H-quinazolin-4-one;(2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone 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-[9-Phenyl-2-(quinolin-3-ylamino)-9H-purin-6-ylamino]-phenyl}-piperidin-1-yl-methanone
CID 24762176
3-[[8-(1-methylindol-6-yl)quinoxalin-6-yl]amino]-~{N}-pyrimidin-5-yl-pyridine-4-carboxamide
CID 122689236
(2P)-2-(isoquinolin-4-yl)-1-[(1s,3R)-3-(methylcarbamoyl)cyclobutyl]-N-{(1S)-1-[4-(trifluoromethyl)phenyl]butyl}-1H-benzimidazole-7-carboxamide
CID 166594726
6-(4-Fluoro-phenyl)-3-[4-(2-methyl-imidazo[4,5-c]pyridin-1-ylmethyl)-piperidine-1-carbonyl]-indole-1-carboxylic acid dimethylamide
CID 10554403
6-(4-fluorophenyl)-N,N-dimethyl-3-[4-(2-methylimidazo[4,5-c]pyridin-1-yl)piperidine-1-carbonyl]indole-1-carboxamide
CID 10625893
[4-(5-Benzylpyrimidin-2-yl)piperazin-1-yl]-[3-(quinazolin-4-ylamino)phenyl]methanone
CID 53249003
[4-(5-Ethylpyrimidin-2-yl)piperazin-1-yl]-[4-[(quinazolin-4-ylamino)methyl]phenyl]methanone
CID 53249004
3-[[8-(1-methylindol-6-yl)quinoxalin-6-yl]amino]-N-(pyrimidin-5-ylmethyl)pyridine-4-carboxamide
CID 122690737
N-[3-butyl-5-(4-methylimidazol-1-yl)phenyl]-4-methyl-3-[(4-phenylpyrimidin-2-yl)amino]benzamide
CID 135331294
4-methyl-N-[3-(4-methylimidazol-1-yl)-5-(4-methylpiperazin-1-yl)phenyl]-3-[(4-phenylpyrimidin-2-yl)amino]benzamide
CID 135331304
4-methyl-N-[3-(4-methylimidazol-1-yl)-5-[(4-methylpiperazin-1-yl)methyl]phenyl]-3-[(4-phenylpyrimidin-2-yl)amino]benzamide
CID 135331337
2-(2-Fluorophenyl)-7-methyl-3-[1-[3-(2-phenylimidazol-1-yl)propyl]piperidin-4-yl]-1,2-dihydroquinazolin-4-one
CID 137639621

Frequently Asked Questions

What is the IUPAC name of [4-(2,3-dimethylimidazol-4-yl)-2-phenylquinazolin-7-yl]-piperidin-1-ylmethanone;(2,4-diphenylquinazolin-7-yl)-piperidin-1-ylmethanone;(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone;2-phenyl-7-(piperidine-1-carbonyl)-3H-quinazolin-4-one;(2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone?
The IUPAC name of [4-(2,3-dimethylimidazol-4-yl)-2-phenylquinazolin-7-yl]-piperidin-1-ylmethanone;(2,4-diphenylquinazolin-7-yl)-piperidin-1-ylmethanone;(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone;2-phenyl-7-(piperidine-1-carbonyl)-3H-quinazolin-4-one;(2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone (CID 159610585) is [4-(2,3-dimethylimidazol-4-yl)-2-phenylquinazolin-7-yl]-piperidin-1-ylmethanone;(2,4-diphenylquinazolin-7-yl)-piperidin-1-ylmethanone;(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone;2-phenyl-7-(piperidine-1-carbonyl)-3H-quinazolin-4-one;(2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for [4-(2,3-dimethylimidazol-4-yl)-2-phenylquinazolin-7-yl]-piperidin-1-ylmethanone;(2,4-diphenylquinazolin-7-yl)-piperidin-1-ylmethanone;(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone;2-phenyl-7-(piperidine-1-carbonyl)-3H-quinazolin-4-one;(2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone?
The canonical SMILES for [4-(2,3-dimethylimidazol-4-yl)-2-phenylquinazolin-7-yl]-piperidin-1-ylmethanone;(2,4-diphenylquinazolin-7-yl)-piperidin-1-ylmethanone;(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone;2-phenyl-7-(piperidine-1-carbonyl)-3H-quinazolin-4-one;(2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone is Cc1nc(-c2ccccc2)nc2cc(C(=O)N3CCCCC3)ccc12.Cc1ncc(-c2nc(-c3ccccc3)nc3cc(C(=O)N4CCCCC4)ccc23)n1C.O=C(c1ccc2c(-c3ccccc3)nc(-c3ccccc3)nc2c1)N1CCCCC1.O=C(c1ccc2c(=O)[nH]c(-c3ccccc3)nc2c1)N1CCCCC1.O=C(c1ccc2cnc(-c3ccccc3)nc2c1)N1CCCCC1.
What is the InChIKey of [4-(2,3-dimethylimidazol-4-yl)-2-phenylquinazolin-7-yl]-piperidin-1-ylmethanone;(2,4-diphenylquinazolin-7-yl)-piperidin-1-ylmethanone;(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone;2-phenyl-7-(piperidine-1-carbonyl)-3H-quinazolin-4-one;(2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone?
The InChIKey is MMQIQRZLKZCRSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N3O.C25H25N5O.C21H21N3O.C20H19N3O2.C20H19N3O/c30-26(29-16-8-3-9-17-29)21-14-15-22-23(18-21)27-25(20-12-6-2-7-13-20)28-24(22)19-10-4-1-5-11-19;1-17-26-16-22(29(17)2)23-20-12-11-19(25(31)30-13-7-4-8-14-30)15-21(20)27-24(28-23)18-9-5-3-6-10-18;1-15-18-11-10-17(21(25)24-12-6-3-7-13-24)14-19(18)23-20(22-15)16-8-4-2-5-9-16;24-19-16-10-9-15(20(25)23-11-5-2-6-12-23)13-17(16)21-18(22-19)14-7-3-1-4-8-14;24-20(23-11-5-2-6-12-23)16-9-10-17-14-21-19(22-18(17)13-16)15-7-3-1-4-8-15/h1-2,4-7,10-15,18H,3,8-9,16-17H2;3,5-6,9-12,15-16H,4,7-8,13-14H2,1-2H3;2,4-5,8-11,14H,3,6-7,12-13H2,1H3;1,3-4,7-10,13H,2,5-6,11-12H2,(H,21,22,24);1,3-4,7-10,13-14H,2,5-6,11-12H2.
What are the key properties of [4-(2,3-dimethylimidazol-4-yl)-2-phenylquinazolin-7-yl]-piperidin-1-ylmethanone;(2,4-diphenylquinazolin-7-yl)-piperidin-1-ylmethanone;(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone;2-phenyl-7-(piperidine-1-carbonyl)-3H-quinazolin-4-one;(2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone?
[4-(2,3-dimethylimidazol-4-yl)-2-phenylquinazolin-7-yl]-piperidin-1-ylmethanone;(2,4-diphenylquinazolin-7-yl)-piperidin-1-ylmethanone;(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone;2-phenyl-7-(piperidine-1-carbonyl)-3H-quinazolin-4-one;(2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone has a molecular weight of 1787.20 g/mol, XLogP of 21.59, 12 rotatable bonds, 1 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,3-dimethylimidazol-4-yl)-2-phenylquinazolin-7-yl]-piperidin-1-ylmethanone;(2,4-diphenylquinazolin-7-yl)-piperidin-1-ylmethanone;(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone;2-phenyl-7-(piperidine-1-carbonyl)-3H-quinazolin-4-one;(2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 159610585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).