N-(3-chlorophenyl)-2-{[(3-chlorophenyl)methyl]sulfanyl}-4-oxo-3-pentyl-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-2-{[(3-chlorophenyl)methyl]sulfanyl}-4-oxo-3-pentyl-3,4-dihydroquinazoline-7-carboxamide
N-(3-chlorophenyl)-2-{[(3-chlorophenyl)methyl]sulfanyl}-4-oxo-3-pentyl-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0016427 |
| Compound Name: | N-(3-chlorophenyl)-2-{[(3-chlorophenyl)methyl]sulfanyl}-4-oxo-3-pentyl-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 526.48 |
| Molecular Formula: | C27 H25 Cl2 N3 O2 S |
| Smiles: | CCCCCN1C(=Nc2cc(ccc2C1=O)C(Nc1cccc(c1)[Cl])=O)SCc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.6376 |
| logD: | 7.6283 |
| logSw: | -6.2624 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.112 |
| InChI Key: | INVHABCXQHETTF-UHFFFAOYSA-N |