3-benzyl-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4-oxo-N-[(oxolan-2-yl)methyl]-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-benzyl-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4-oxo-N-[(oxolan-2-yl)methyl]-3,4-dihydroquinazoline-7-carboxamide
3-benzyl-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4-oxo-N-[(oxolan-2-yl)methyl]-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | F067-1100 |
| Compound Name: | 3-benzyl-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4-oxo-N-[(oxolan-2-yl)methyl]-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 531.61 |
| Molecular Formula: | C29 H26 F N3 O4 S |
| Smiles: | C1CC(CNC(c2ccc3C(N(Cc4ccccc4)C(=Nc3c2)SCC(c2ccc(cc2)F)=O)=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6903 |
| logD: | 3.6903 |
| logSw: | -4.0962 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.086 |
| InChI Key: | OLMXLZFGDGDPOI-HSZRJFAPSA-N |