2-({4-amino-5-[4-(propan-2-yl)benzene-1-sulfonyl]pyrimidin-2-yl}sulfanyl)-N-(4-ethylphenyl)butanamide
Chemical Structure Depiction of
2-({4-amino-5-[4-(propan-2-yl)benzene-1-sulfonyl]pyrimidin-2-yl}sulfanyl)-N-(4-ethylphenyl)butanamide
2-({4-amino-5-[4-(propan-2-yl)benzene-1-sulfonyl]pyrimidin-2-yl}sulfanyl)-N-(4-ethylphenyl)butanamide
Compound characteristics
| Compound ID: | E682-0063 |
| Compound Name: | 2-({4-amino-5-[4-(propan-2-yl)benzene-1-sulfonyl]pyrimidin-2-yl}sulfanyl)-N-(4-ethylphenyl)butanamide |
| Molecular Weight: | 498.67 |
| Molecular Formula: | C25 H30 N4 O3 S2 |
| Smiles: | CCC(C(Nc1ccc(CC)cc1)=O)Sc1ncc(c(N)n1)S(c1ccc(cc1)C(C)C)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.921 |
| logD: | 5.921 |
| logSw: | -5.4052 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.342 |
| InChI Key: | MNSDOEIPRFIYRU-NRFANRHFSA-N |