N-cyclohexyl-2-(4-methylpiperazin-1-yl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
Chemical Structure Depiction of
N-cyclohexyl-2-(4-methylpiperazin-1-yl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
N-cyclohexyl-2-(4-methylpiperazin-1-yl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
Compound characteristics
| Compound ID: | C094-2375 |
| Compound Name: | N-cyclohexyl-2-(4-methylpiperazin-1-yl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide |
| Molecular Weight: | 404.46 |
| Molecular Formula: | C20 H28 N4 O5 |
| Smiles: | CN1CCN(CC1)C(C(NC1CCCCC1)=O)c1cc2c(cc1[N+]([O-])=O)OCO2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4542 |
| logD: | 2.08 |
| logSw: | -2.7748 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.075 |
| InChI Key: | LTNZXJWERHBZKQ-LJQANCHMSA-N |