4-{[(4-methoxyphenyl)methyl]amino}-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide
Chemical Structure Depiction of
4-{[(4-methoxyphenyl)methyl]amino}-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide
4-{[(4-methoxyphenyl)methyl]amino}-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide
Compound characteristics
| Compound ID: | K781-7285 |
| Compound Name: | 4-{[(4-methoxyphenyl)methyl]amino}-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide |
| Molecular Weight: | 445.4 |
| Molecular Formula: | C22 H18 F3 N3 O4 |
| Smiles: | COc1ccc(CNc2ccc(cc2[N+]([O-])=O)C(Nc2ccc(cc2)C(F)(F)F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0711 |
| logD: | 5.0692 |
| logSw: | -4.8481 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.491 |
| InChI Key: | GBQOOVOUTUXHEJ-UHFFFAOYSA-N |