ethyl [(7-{[(2-chlorophenyl)methyl]carbamoyl}-3-cyclohexyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
ethyl [(7-{[(2-chlorophenyl)methyl]carbamoyl}-3-cyclohexyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate
ethyl [(7-{[(2-chlorophenyl)methyl]carbamoyl}-3-cyclohexyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | A0016093 |
| Compound Name: | ethyl [(7-{[(2-chlorophenyl)methyl]carbamoyl}-3-cyclohexyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate |
| Molecular Weight: | 514.04 |
| Molecular Formula: | C26 H28 Cl N3 O4 S |
| Smiles: | CCOC(CSC1=Nc2cc(ccc2C(N1C1CCCCC1)=O)C(NCc1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0465 |
| logD: | 5.0464 |
| logSw: | -5.0845 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.836 |
| InChI Key: | OHWRACSBVOLYAB-UHFFFAOYSA-N |