N-[2-(4-chlorophenyl)ethyl]-2-{[5-(3,5-dichlorobenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-2-{[5-(3,5-dichlorobenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
N-[2-(4-chlorophenyl)ethyl]-2-{[5-(3,5-dichlorobenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G605-0599 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-2-{[5-(3,5-dichlorobenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 532.85 |
| Molecular Formula: | C20 H16 Cl3 N3 O4 S2 |
| Smiles: | C(CNC(CSC1NC(C(=CN=1)S(c1cc(cc(c1)[Cl])[Cl])(=O)=O)=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.1306 |
| logD: | 1.4888 |
| logSw: | -3.749 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.304 |
| InChI Key: | DLWIFRFATCEDIR-UHFFFAOYSA-N |