ethyl {[7-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[7-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate
ethyl {[7-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | A0015892 |
| Compound Name: | ethyl {[7-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 519.66 |
| Molecular Formula: | C29 H33 N3 O4 S |
| Smiles: | CCOC(CSC1=Nc2cc(ccc2C(N1CCc1ccccc1)=O)C(NCCC1CCCCC=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5977 |
| logD: | 4.5977 |
| logSw: | -4.273 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.627 |
| InChI Key: | HGRHPUVVGPAODX-UHFFFAOYSA-N |