N-(3-chloro-4-fluorophenyl)-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide
N-(3-chloro-4-fluorophenyl)-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | C200-3359 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 495.98 |
| Molecular Formula: | C21 H19 Cl F N3 O4 S2 |
| Smiles: | CC(C)c1ccc(cc1)S(C1=CN=C(NC1=O)SCC(Nc1ccc(c(c1)[Cl])F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0868 |
| logD: | 2.4451 |
| logSw: | -4.501 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.14 |
| InChI Key: | WNGBYAGHKKQZOY-UHFFFAOYSA-N |