N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}-2-(4-nitrophenoxy)acetamide
Chemical Structure Depiction of
N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}-2-(4-nitrophenoxy)acetamide
N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}-2-(4-nitrophenoxy)acetamide
Compound characteristics
| Compound ID: | D335-0720 |
| Compound Name: | N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}-2-(4-nitrophenoxy)acetamide |
| Molecular Weight: | 390.48 |
| Molecular Formula: | C20 H30 N4 O4 |
| Smiles: | CN1CCN(CC1)C1(CCCCC1)CNC(COc1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.586 |
| logD: | 2.1645 |
| logSw: | -2.9205 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.029 |
| InChI Key: | CLCJJVWIQZHENB-UHFFFAOYSA-N |