N-benzyl-2,4-dinitro-N-(2-{[4-(trifluoromethyl)phenyl]carbamoyl}phenyl)benzamide
Chemical Structure Depiction of
N-benzyl-2,4-dinitro-N-(2-{[4-(trifluoromethyl)phenyl]carbamoyl}phenyl)benzamide
N-benzyl-2,4-dinitro-N-(2-{[4-(trifluoromethyl)phenyl]carbamoyl}phenyl)benzamide
Compound characteristics
| Compound ID: | 8018-2079 |
| Compound Name: | N-benzyl-2,4-dinitro-N-(2-{[4-(trifluoromethyl)phenyl]carbamoyl}phenyl)benzamide |
| Molecular Weight: | 564.48 |
| Molecular Formula: | C28 H19 F3 N4 O6 |
| Smiles: | C(c1ccccc1)N(C(c1ccc(cc1[N+]([O-])=O)[N+]([O-])=O)=O)c1ccccc1C(Nc1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0867 |
| logD: | 6.0866 |
| logSw: | -6.0609 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.842 |
| InChI Key: | FFSZRKDAWMVCTB-UHFFFAOYSA-N |