N-[3-(methylsulfanyl)phenyl]-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide
N-[3-(methylsulfanyl)phenyl]-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | C716-0373 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 489.63 |
| Molecular Formula: | C22 H23 N3 O4 S3 |
| Smiles: | CC(C)c1ccc(cc1)S(C1=CN=C(NC1=O)SCC(Nc1cccc(c1)SC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8176 |
| logD: | 2.1759 |
| logSw: | -3.8855 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.14 |
| InChI Key: | ZSZBABCBKCLWET-UHFFFAOYSA-N |