3,5-dimethyl-N-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]benzamide
Chemical Structure Depiction of
3,5-dimethyl-N-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]benzamide
3,5-dimethyl-N-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]benzamide
Compound characteristics
| Compound ID: | Y205-0526 |
| Compound Name: | 3,5-dimethyl-N-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]benzamide |
| Molecular Weight: | 368.31 |
| Molecular Formula: | C17 H15 F3 N2 O4 |
| Smiles: | Cc1cc(C)cc(c1)C(Nc1cc(cc(c1)OCC(F)(F)F)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8641 |
| logD: | 3.9432 |
| logSw: | -4.659 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.21 |
| InChI Key: | QYMIUOVRNNPABI-UHFFFAOYSA-N |