N-(3-fluoro-4-methylphenyl)-4-{[3-(4-methylpiperidin-1-yl)propyl]amino}-3-nitrobenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-(3-fluoro-4-methylphenyl)-4-{[3-(4-methylpiperidin-1-yl)propyl]amino}-3-nitrobenzamide--hydrogen chloride (1/1)
N-(3-fluoro-4-methylphenyl)-4-{[3-(4-methylpiperidin-1-yl)propyl]amino}-3-nitrobenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | K784-1657 |
| Compound Name: | N-(3-fluoro-4-methylphenyl)-4-{[3-(4-methylpiperidin-1-yl)propyl]amino}-3-nitrobenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 464.97 |
| Molecular Formula: | C23 H29 F N4 O3 |
| Salt: | HCl |
| Smiles: | CC1CCN(CCCNc2ccc(cc2[N+]([O-])=O)C(Nc2ccc(C)c(c2)F)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.8446 |
| logD: | 3.0117 |
| logSw: | -4.5771 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.771 |
| InChI Key: | DBJNKIOTKAPNHU-UHFFFAOYSA-N |