N-(2,6-dimethylphenyl)-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)butanamide
Chemical Structure Depiction of
N-(2,6-dimethylphenyl)-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)butanamide
N-(2,6-dimethylphenyl)-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)butanamide
Compound characteristics
| Compound ID: | C716-0388 |
| Compound Name: | N-(2,6-dimethylphenyl)-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)butanamide |
| Molecular Weight: | 499.65 |
| Molecular Formula: | C25 H29 N3 O4 S2 |
| Smiles: | CCC(C(Nc1c(C)cccc1C)=O)SC1NC(C(=CN=1)S(c1ccc(cc1)C(C)C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8023 |
| logD: | 3.5902 |
| logSw: | -4.4276 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.958 |
| InChI Key: | ROHKUFQABZFJAL-FQEVSTJZSA-N |