4-methyl-N-{2-[2-nitro-4-(trifluoromethyl)anilino]ethyl}benzamide
Chemical Structure Depiction of
4-methyl-N-{2-[2-nitro-4-(trifluoromethyl)anilino]ethyl}benzamide
4-methyl-N-{2-[2-nitro-4-(trifluoromethyl)anilino]ethyl}benzamide
Compound characteristics
| Compound ID: | 2369-0665 |
| Compound Name: | 4-methyl-N-{2-[2-nitro-4-(trifluoromethyl)anilino]ethyl}benzamide |
| Molecular Weight: | 367.33 |
| Molecular Formula: | C17 H16 F3 N3 O3 |
| Smiles: | Cc1ccc(cc1)C(NCCNc1ccc(cc1[N+]([O-])=O)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7327 |
| logD: | 3.7327 |
| logSw: | -4.0571 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.224 |
| InChI Key: | UPDQJRYISXFVEH-UHFFFAOYSA-N |