N-(3-chloro-4-fluorophenyl)-4-(4-nitrobenzene-1-sulfonyl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-4-(4-nitrobenzene-1-sulfonyl)piperazine-1-carboxamide
N-(3-chloro-4-fluorophenyl)-4-(4-nitrobenzene-1-sulfonyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | Y205-4577 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-4-(4-nitrobenzene-1-sulfonyl)piperazine-1-carboxamide |
| Molecular Weight: | 442.85 |
| Molecular Formula: | C17 H16 Cl F N4 O5 S |
| Smiles: | C1CN(CCN1C(Nc1ccc(c(c1)[Cl])F)=O)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1808 |
| logD: | 3.1803 |
| logSw: | -3.6617 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.608 |
| InChI Key: | GJTJEOWMNBUJPD-UHFFFAOYSA-N |