N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}-3-nitrobenzamide
Chemical Structure Depiction of
N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}-3-nitrobenzamide
N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}-3-nitrobenzamide
Compound characteristics
| Compound ID: | D335-0777 |
| Compound Name: | N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}-3-nitrobenzamide |
| Molecular Weight: | 360.46 |
| Molecular Formula: | C19 H28 N4 O3 |
| Smiles: | CN1CCN(CC1)C1(CCCCC1)CNC(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7144 |
| logD: | 2.5229 |
| logSw: | -3.1627 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.743 |
| InChI Key: | JXAKRXRTYBQQQF-UHFFFAOYSA-N |