N-(3,5-difluorophenyl)-4-{[3-(4-methylpiperidin-1-yl)propyl]amino}-3-nitrobenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-(3,5-difluorophenyl)-4-{[3-(4-methylpiperidin-1-yl)propyl]amino}-3-nitrobenzamide--hydrogen chloride (1/1)
N-(3,5-difluorophenyl)-4-{[3-(4-methylpiperidin-1-yl)propyl]amino}-3-nitrobenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | K784-1660 |
| Compound Name: | N-(3,5-difluorophenyl)-4-{[3-(4-methylpiperidin-1-yl)propyl]amino}-3-nitrobenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 468.93 |
| Molecular Formula: | C22 H26 F2 N4 O3 |
| Salt: | HCl |
| Smiles: | CC1CCN(CCCNc2ccc(cc2[N+]([O-])=O)C(Nc2cc(cc(c2)F)F)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.6572 |
| logD: | 4.6572 |
| logSw: | -4.3342 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.771 |
| InChI Key: | DAFGCMZVIJBSID-UHFFFAOYSA-N |