3-(4-bromo-3-methylanilino)-2-[4-(trifluoromethyl)phenyl]-1H-inden-1-one
Chemical Structure Depiction of
3-(4-bromo-3-methylanilino)-2-[4-(trifluoromethyl)phenyl]-1H-inden-1-one
3-(4-bromo-3-methylanilino)-2-[4-(trifluoromethyl)phenyl]-1H-inden-1-one
Compound characteristics
| Compound ID: | C301-6097 |
| Compound Name: | 3-(4-bromo-3-methylanilino)-2-[4-(trifluoromethyl)phenyl]-1H-inden-1-one |
| Molecular Weight: | 458.28 |
| Molecular Formula: | C23 H15 Br F3 N O |
| Smiles: | Cc1cc(ccc1[Br])NC1=C(C(c2ccccc12)=O)c1ccc(cc1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.9314 |
| logD: | 6.9065 |
| logSw: | -5.7177 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 22.5113 |
| InChI Key: | PZRDOXGPONCPOH-UHFFFAOYSA-N |