4-({3-[benzyl(methyl)amino]propyl}amino)-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide
Chemical Structure Depiction of
4-({3-[benzyl(methyl)amino]propyl}amino)-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide
4-({3-[benzyl(methyl)amino]propyl}amino)-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide
Compound characteristics
| Compound ID: | K784-1446 |
| Compound Name: | 4-({3-[benzyl(methyl)amino]propyl}amino)-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide |
| Molecular Weight: | 486.49 |
| Molecular Formula: | C25 H25 F3 N4 O3 |
| Smiles: | CN(CCCNc1ccc(cc1[N+]([O-])=O)C(Nc1ccc(cc1)C(F)(F)F)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2657 |
| logD: | 4.408 |
| logSw: | -5.1621 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.883 |
| InChI Key: | QBTMOHMNWWUKLY-UHFFFAOYSA-N |