N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]acetamide
Chemical Structure Depiction of
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]acetamide
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]acetamide
Compound characteristics
| Compound ID: | K940-0376 |
| Compound Name: | N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]acetamide |
| Molecular Weight: | 506.89 |
| Molecular Formula: | C19 H18 Cl F3 N4 O5 S |
| Smiles: | C1CN(CCN1CC(Nc1ccc(c(c1)C(F)(F)F)[Cl])=O)S(c1cccc(c1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2192 |
| logD: | 4.1756 |
| logSw: | -4.6339 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.021 |
| InChI Key: | AQOCTOMVXLTTKT-UHFFFAOYSA-N |