3-(3,5-dimethylphenyl)-2-{[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl}-4-oxo-N-(propan-2-yl)-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-(3,5-dimethylphenyl)-2-{[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl}-4-oxo-N-(propan-2-yl)-3,4-dihydroquinazoline-7-carboxamide
3-(3,5-dimethylphenyl)-2-{[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl}-4-oxo-N-(propan-2-yl)-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | F067-0464 |
| Compound Name: | 3-(3,5-dimethylphenyl)-2-{[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl}-4-oxo-N-(propan-2-yl)-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 527.69 |
| Molecular Formula: | C31 H33 N3 O3 S |
| Smiles: | CC(C)NC(c1ccc2C(N(C(=Nc2c1)SC(C)C(c1ccc(C)c(C)c1)=O)c1cc(C)cc(C)c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4748 |
| logD: | 6.4731 |
| logSw: | -5.6203 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.557 |
| InChI Key: | AAYKAUUCMQIDFI-QFIPXVFZSA-N |