2-{benzyl[2-nitro-4-(trifluoromethyl)phenyl]amino}ethyl benzoate
Chemical Structure Depiction of
2-{benzyl[2-nitro-4-(trifluoromethyl)phenyl]amino}ethyl benzoate
2-{benzyl[2-nitro-4-(trifluoromethyl)phenyl]amino}ethyl benzoate
Compound characteristics
| Compound ID: | 8015-0779 |
| Compound Name: | 2-{benzyl[2-nitro-4-(trifluoromethyl)phenyl]amino}ethyl benzoate |
| Molecular Weight: | 444.41 |
| Molecular Formula: | C23 H19 F3 N2 O4 |
| Smiles: | C(COC(c1ccccc1)=O)N(Cc1ccccc1)c1ccc(cc1[N+]([O-])=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.9714 |
| logD: | 5.9714 |
| logSw: | -6.2225 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.788 |
| InChI Key: | SDNPETXCBDVCKD-UHFFFAOYSA-N |