N-[(2-chlorophenyl)methyl]-2-{[(3-chlorophenyl)methyl]sulfanyl}-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-2-{[(3-chlorophenyl)methyl]sulfanyl}-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazoline-7-carboxamide
N-[(2-chlorophenyl)methyl]-2-{[(3-chlorophenyl)methyl]sulfanyl}-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0016033 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-2-{[(3-chlorophenyl)methyl]sulfanyl}-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 574.53 |
| Molecular Formula: | C31 H25 Cl2 N3 O2 S |
| Smiles: | C(CN1C(=Nc2cc(ccc2C1=O)C(NCc1ccccc1[Cl])=O)SCc1cccc(c1)[Cl])c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 7.1221 |
| logD: | 7.122 |
| logSw: | -6.4276 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.163 |
| InChI Key: | XDQQNUSTTNBACC-UHFFFAOYSA-N |