2-{[5-cyano-4-(4-methylphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,4-dimethylphenyl)propanamide
Chemical Structure Depiction of
2-{[5-cyano-4-(4-methylphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,4-dimethylphenyl)propanamide
2-{[5-cyano-4-(4-methylphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,4-dimethylphenyl)propanamide
Compound characteristics
| Compound ID: | D285-0268 |
| Compound Name: | 2-{[5-cyano-4-(4-methylphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,4-dimethylphenyl)propanamide |
| Molecular Weight: | 418.52 |
| Molecular Formula: | C23 H22 N4 O2 S |
| Smiles: | CC(C(Nc1ccc(C)cc1C)=O)SC1NC(C(C#N)=C(c2ccc(C)cc2)N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5832 |
| logD: | 1.4771 |
| logSw: | -4.3061 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.103 |
| InChI Key: | XXUSBFSNIUNWRF-INIZCTEOSA-N |