N-[(3-chlorophenyl)methyl]-3-cyclohexyl-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-3-cyclohexyl-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
N-[(3-chlorophenyl)methyl]-3-cyclohexyl-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0016174 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-3-cyclohexyl-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 526.1 |
| Molecular Formula: | C28 H32 Cl N3 O3 S |
| Smiles: | CC(C)(C)C(CSC1=Nc2cc(ccc2C(N1C1CCCCC1)=O)C(NCc1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8789 |
| logD: | 5.8789 |
| logSw: | -5.8342 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.924 |
| InChI Key: | VHCZFTDITCITKV-UHFFFAOYSA-N |