N-[2-(4-methoxyphenyl)-2-(pyrrolidin-1-yl)ethyl]-3-nitrobenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[2-(4-methoxyphenyl)-2-(pyrrolidin-1-yl)ethyl]-3-nitrobenzamide--hydrogen chloride (1/1)
N-[2-(4-methoxyphenyl)-2-(pyrrolidin-1-yl)ethyl]-3-nitrobenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D307-0003 |
| Compound Name: | N-[2-(4-methoxyphenyl)-2-(pyrrolidin-1-yl)ethyl]-3-nitrobenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 405.88 |
| Molecular Formula: | C20 H23 N3 O4 |
| Salt: | HCl |
| Smiles: | [H]N(CC(c1ccc(cc1)OC)N1CCCC1)C(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8851 |
| logD: | 2.5829 |
| logSw: | -3.4086 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.932 |
| InChI Key: | ZKLJCXWJOIPZTA-IBGZPJMESA-N |