ethyl 4-{3-cyclohexyl-2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carbonyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{3-cyclohexyl-2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carbonyl}piperazine-1-carboxylate
ethyl 4-{3-cyclohexyl-2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carbonyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | A0016083 |
| Compound Name: | ethyl 4-{3-cyclohexyl-2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carbonyl}piperazine-1-carboxylate |
| Molecular Weight: | 530.64 |
| Molecular Formula: | C26 H34 N4 O6 S |
| Smiles: | CCOC(CSC1=Nc2cc(ccc2C(N1C1CCCCC1)=O)C(N1CCN(CC1)C(=O)OCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1333 |
| logD: | 3.1333 |
| logSw: | -3.3809 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 84.851 |
| InChI Key: | ZPRPGHHCWUWDEE-UHFFFAOYSA-N |