2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-N-(3,5-dimethylphenyl)-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-N-(3,5-dimethylphenyl)-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazoline-7-carboxamide
2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-N-(3,5-dimethylphenyl)-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0015976 |
| Compound Name: | 2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-N-(3,5-dimethylphenyl)-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 527.69 |
| Molecular Formula: | C31 H33 N3 O3 S |
| Smiles: | Cc1cc(C)cc(c1)NC(c1ccc2C(N(CCc3ccccc3)C(=Nc2c1)SCC(C(C)(C)C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2379 |
| logD: | 6.2378 |
| logSw: | -5.4041 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.359 |
| InChI Key: | XQVGPAVKMMOKNW-UHFFFAOYSA-N |