2-{[5-(2,4-dimethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,5-dimethylphenyl)butanamide
Chemical Structure Depiction of
2-{[5-(2,4-dimethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,5-dimethylphenyl)butanamide
2-{[5-(2,4-dimethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,5-dimethylphenyl)butanamide
Compound characteristics
| Compound ID: | C716-0247 |
| Compound Name: | 2-{[5-(2,4-dimethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,5-dimethylphenyl)butanamide |
| Molecular Weight: | 485.62 |
| Molecular Formula: | C24 H27 N3 O4 S2 |
| Smiles: | CCC(C(Nc1cc(C)ccc1C)=O)SC1NC(C(=CN=1)S(c1ccc(C)cc1C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2686 |
| logD: | 3.0565 |
| logSw: | -4.1293 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.656 |
| InChI Key: | DYNJVEDBGJGTLA-IBGZPJMESA-N |