N-[rel-(1R,2R)-2-(4-fluorobenzamido)cyclohexyl]-1-(4-nitrobenzene-1-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[rel-(1R,2R)-2-(4-fluorobenzamido)cyclohexyl]-1-(4-nitrobenzene-1-sulfonyl)piperidine-3-carboxamide
N-[rel-(1R,2R)-2-(4-fluorobenzamido)cyclohexyl]-1-(4-nitrobenzene-1-sulfonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | V010-2148 |
| Compound Name: | N-[rel-(1R,2R)-2-(4-fluorobenzamido)cyclohexyl]-1-(4-nitrobenzene-1-sulfonyl)piperidine-3-carboxamide |
| Molecular Weight: | 532.59 |
| Molecular Formula: | C25 H29 F N4 O6 S |
| Smiles: | C1CC[C@H]([C@@H](C1)NC(C1CCCN(C1)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O)=O)NC(c1ccc(cc1)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9557 |
| logD: | 2.9557 |
| logSw: | -3.5729 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 114.13 |
| InChI Key: | DPMGFHGEYROXQT-YMDSNFKLSA-N |