2-nitro-N-(4-phenylbutan-2-yl)-5-(piperazin-1-yl)aniline--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-nitro-N-(4-phenylbutan-2-yl)-5-(piperazin-1-yl)aniline--hydrogen chloride (1/1)
2-nitro-N-(4-phenylbutan-2-yl)-5-(piperazin-1-yl)aniline--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 3159-1012 |
| Compound Name: | 2-nitro-N-(4-phenylbutan-2-yl)-5-(piperazin-1-yl)aniline--hydrogen chloride (1/1) |
| Molecular Weight: | 390.91 |
| Molecular Formula: | C20 H26 N4 O2 |
| Salt: | HCl |
| Smiles: | CC(CCc1ccccc1)Nc1cc(ccc1[N+]([O-])=O)N1CCNCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6123 |
| logD: | 2.2862 |
| logSw: | -3.9251 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.71 |
| InChI Key: | KZLJTSGHAWLPDM-INIZCTEOSA-N |