2-(6-bromo-2H-1,3-benzodioxol-5-yl)-6-[4-(trifluoromethyl)phenyl]-1,3-benzoxazole
Chemical Structure Depiction of
2-(6-bromo-2H-1,3-benzodioxol-5-yl)-6-[4-(trifluoromethyl)phenyl]-1,3-benzoxazole
2-(6-bromo-2H-1,3-benzodioxol-5-yl)-6-[4-(trifluoromethyl)phenyl]-1,3-benzoxazole
Compound characteristics
| Compound ID: | V007-5341 |
| Compound Name: | 2-(6-bromo-2H-1,3-benzodioxol-5-yl)-6-[4-(trifluoromethyl)phenyl]-1,3-benzoxazole |
| Molecular Weight: | 462.22 |
| Molecular Formula: | C21 H11 Br F3 N O3 |
| Smiles: | C1Oc2cc(c(cc2O1)[Br])c1nc2ccc(cc2o1)c1ccc(cc1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 7.105 |
| logD: | 7.105 |
| logSw: | -6.4421 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.893 |
| InChI Key: | MJPVGZXGPJRWJD-UHFFFAOYSA-N |