N-[rel-(1R,2R)-2-benzamidocyclohexyl]-1-(4-nitrobenzene-1-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[rel-(1R,2R)-2-benzamidocyclohexyl]-1-(4-nitrobenzene-1-sulfonyl)piperidine-4-carboxamide
N-[rel-(1R,2R)-2-benzamidocyclohexyl]-1-(4-nitrobenzene-1-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | V012-3002 |
| Compound Name: | N-[rel-(1R,2R)-2-benzamidocyclohexyl]-1-(4-nitrobenzene-1-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 514.6 |
| Molecular Formula: | C25 H30 N4 O6 S |
| Smiles: | C1CC[C@H]([C@@H](C1)NC(C1CCN(CC1)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O)=O)NC(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.9052 |
| logD: | 2.9052 |
| logSw: | -3.5118 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 114.196 |
| InChI Key: | IHIYSJGKYVEKRD-DHIUTWEWSA-N |