ethyl 4-{4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-pentyl-3,4-dihydroquinazoline-7-carbonyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-pentyl-3,4-dihydroquinazoline-7-carbonyl}piperazine-1-carboxylate
ethyl 4-{4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-pentyl-3,4-dihydroquinazoline-7-carbonyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | A0016383 |
| Compound Name: | ethyl 4-{4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-pentyl-3,4-dihydroquinazoline-7-carbonyl}piperazine-1-carboxylate |
| Molecular Weight: | 550.68 |
| Molecular Formula: | C29 H34 N4 O5 S |
| Smiles: | CCCCCN1C(=Nc2cc(ccc2C1=O)C(N1CCN(CC1)C(=O)OCC)=O)SCC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1834 |
| logD: | 4.1834 |
| logSw: | -4.1 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 78.696 |
| InChI Key: | WDTSBLORWRHTHI-UHFFFAOYSA-N |