3-benzyl-N-(3,5-dimethylphenyl)-4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-benzyl-N-(3,5-dimethylphenyl)-4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,4-dihydroquinazoline-7-carboxamide
3-benzyl-N-(3,5-dimethylphenyl)-4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0015796 |
| Compound Name: | 3-benzyl-N-(3,5-dimethylphenyl)-4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 533.65 |
| Molecular Formula: | C32 H27 N3 O3 S |
| Smiles: | Cc1cc(C)cc(c1)NC(c1ccc2C(N(Cc3ccccc3)C(=Nc2c1)SCC(c1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0327 |
| logD: | 6.0326 |
| logSw: | -5.4583 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.109 |
| InChI Key: | CEIRCSFSNKHXOI-UHFFFAOYSA-N |