4-oxo-N-[(oxolan-2-yl)methyl]-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-(prop-2-en-1-yl)-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
4-oxo-N-[(oxolan-2-yl)methyl]-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-(prop-2-en-1-yl)-3,4-dihydroquinazoline-7-carboxamide
4-oxo-N-[(oxolan-2-yl)methyl]-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-(prop-2-en-1-yl)-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K289-0226 |
| Compound Name: | 4-oxo-N-[(oxolan-2-yl)methyl]-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-(prop-2-en-1-yl)-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 463.55 |
| Molecular Formula: | C25 H25 N3 O4 S |
| Smiles: | C=CCN1C(=Nc2cc(ccc2C1=O)C(NCC1CCCO1)=O)SCC(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4401 |
| logD: | 2.4401 |
| logSw: | -3.1834 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.336 |
| InChI Key: | PAIXHODGCGZUBM-LJQANCHMSA-N |