N-(3-chlorophenyl)-3-cyclohexyl-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-3-cyclohexyl-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
N-(3-chlorophenyl)-3-cyclohexyl-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
Compound ID: | A0016167 |
Compound Name: | N-(3-chlorophenyl)-3-cyclohexyl-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
Molecular Weight: | 512.07 |
Molecular Formula: | C27 H30 Cl N3 O3 S |
Smiles: | CC(C)(C)C(CSC1=Nc2cc(ccc2C(N1C1CCCCC1)=O)C(Nc1cccc(c1)[Cl])=O)=O |
Stereo: | ACHIRAL |
logP: | 6.2692 |
logD: | 6.2599 |
logSw: | -6.0077 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.602 |
InChI Key: | OMUDKXDRFIKWDK-UHFFFAOYSA-N |