4-({3-[benzyl(methyl)amino]propyl}amino)-N-(2,5-dimethylphenyl)-3-nitrobenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-({3-[benzyl(methyl)amino]propyl}amino)-N-(2,5-dimethylphenyl)-3-nitrobenzamide--hydrogen chloride (1/1)
4-({3-[benzyl(methyl)amino]propyl}amino)-N-(2,5-dimethylphenyl)-3-nitrobenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | K784-1666 |
| Compound Name: | 4-({3-[benzyl(methyl)amino]propyl}amino)-N-(2,5-dimethylphenyl)-3-nitrobenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 483.01 |
| Molecular Formula: | C26 H30 N4 O3 |
| Salt: | HCl |
| Smiles: | Cc1ccc(C)c(c1)NC(c1ccc(c(c1)[N+]([O-])=O)NCCCN(C)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6324 |
| logD: | 3.7747 |
| logSw: | -4.3513 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.185 |
| InChI Key: | RKVANGDTMDLBNF-UHFFFAOYSA-N |