methyl 3-oxo-4-{[4-oxo-3-(2-phenylethyl)-7-(propylcarbamoyl)-3,4-dihydroquinazolin-2-yl]sulfanyl}butanoate
Chemical Structure Depiction of
methyl 3-oxo-4-{[4-oxo-3-(2-phenylethyl)-7-(propylcarbamoyl)-3,4-dihydroquinazolin-2-yl]sulfanyl}butanoate
methyl 3-oxo-4-{[4-oxo-3-(2-phenylethyl)-7-(propylcarbamoyl)-3,4-dihydroquinazolin-2-yl]sulfanyl}butanoate
Compound characteristics
| Compound ID: | F067-0101 |
| Compound Name: | methyl 3-oxo-4-{[4-oxo-3-(2-phenylethyl)-7-(propylcarbamoyl)-3,4-dihydroquinazolin-2-yl]sulfanyl}butanoate |
| Molecular Weight: | 481.57 |
| Molecular Formula: | C25 H27 N3 O5 S |
| Smiles: | CCCNC(c1ccc2C(N(CCc3ccccc3)C(=Nc2c1)SCC(CC(=O)OC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.654 |
| logD: | 2.6538 |
| logSw: | -3.2674 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.882 |
| InChI Key: | UYSKHIZTVJNIGZ-UHFFFAOYSA-N |