N-{[1-(dimethylamino)cyclohexyl]methyl}-3-nitrobenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-{[1-(dimethylamino)cyclohexyl]methyl}-3-nitrobenzamide--hydrogen chloride (1/1)
N-{[1-(dimethylamino)cyclohexyl]methyl}-3-nitrobenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D335-0338 |
| Compound Name: | N-{[1-(dimethylamino)cyclohexyl]methyl}-3-nitrobenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 341.84 |
| Molecular Formula: | C16 H23 N3 O3 |
| Salt: | HCl |
| Smiles: | CN(C)C1(CCCCC1)CNC(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7709 |
| logD: | 1.9814 |
| logSw: | -3.2142 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.619 |
| InChI Key: | VPFORBXFKGRFJU-UHFFFAOYSA-N |