4-{[3-(3,5-dimethylpiperidin-1-yl)propyl]amino}-N-(4-ethoxyphenyl)-3-nitrobenzamide
Chemical Structure Depiction of
4-{[3-(3,5-dimethylpiperidin-1-yl)propyl]amino}-N-(4-ethoxyphenyl)-3-nitrobenzamide
4-{[3-(3,5-dimethylpiperidin-1-yl)propyl]amino}-N-(4-ethoxyphenyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | K784-1421 |
| Compound Name: | 4-{[3-(3,5-dimethylpiperidin-1-yl)propyl]amino}-N-(4-ethoxyphenyl)-3-nitrobenzamide |
| Molecular Weight: | 454.57 |
| Molecular Formula: | C25 H34 N4 O4 |
| Smiles: | CCOc1ccc(cc1)NC(c1ccc(c(c1)[N+]([O-])=O)NCCCN1CC(C)CC(C)C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0128 |
| logD: | 3.0941 |
| logSw: | -4.4509 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.761 |
| InChI Key: | XNBBDGRHBYXABL-UHFFFAOYSA-N |