3-(3-methylbutyl)-4-oxo-N-[(oxolan-2-yl)methyl]-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-(3-methylbutyl)-4-oxo-N-[(oxolan-2-yl)methyl]-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,4-dihydroquinazoline-7-carboxamide
3-(3-methylbutyl)-4-oxo-N-[(oxolan-2-yl)methyl]-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | F067-1373 |
| Compound Name: | 3-(3-methylbutyl)-4-oxo-N-[(oxolan-2-yl)methyl]-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 493.62 |
| Molecular Formula: | C27 H31 N3 O4 S |
| Smiles: | CC(C)CCN1C(=Nc2cc(ccc2C1=O)C(NCC1CCCO1)=O)SCC(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5328 |
| logD: | 3.5328 |
| logSw: | -3.9236 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.336 |
| InChI Key: | PXMLGDWKUSJVRD-OAQYLSRUSA-N |