N-[2-bromo-5-(trifluoromethyl)phenyl]-3-methyl-4-nitrobenzamide
Chemical Structure Depiction of
N-[2-bromo-5-(trifluoromethyl)phenyl]-3-methyl-4-nitrobenzamide
N-[2-bromo-5-(trifluoromethyl)phenyl]-3-methyl-4-nitrobenzamide
Compound characteristics
Compound ID: | 8006-5432 |
Compound Name: | N-[2-bromo-5-(trifluoromethyl)phenyl]-3-methyl-4-nitrobenzamide |
Molecular Weight: | 403.15 |
Molecular Formula: | C15 H10 Br F3 N2 O3 |
Smiles: | Cc1cc(ccc1[N+]([O-])=O)C(Nc1cc(ccc1[Br])C(F)(F)F)=O |
Stereo: | ACHIRAL |
logP: | 5.0451 |
logD: | 4.5813 |
logSw: | -4.8004 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.712 |
InChI Key: | FXUNBISKPGJJKF-UHFFFAOYSA-N |