(4-bromophenyl)[3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]methanone
Chemical Structure Depiction of
(4-bromophenyl)[3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]methanone
(4-bromophenyl)[3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]methanone
Compound characteristics
| Compound ID: | 4607-0190 |
| Compound Name: | (4-bromophenyl)[3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]methanone |
| Molecular Weight: | 391.19 |
| Molecular Formula: | C15 H14 Br F3 N2 O2 |
| Smiles: | C1CCC2C(C1)C(C(F)(F)F)(N(C(c1ccc(cc1)[Br])=O)N=2)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0215 |
| logD: | 4.0215 |
| logSw: | -4.2301 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.921 |
| InChI Key: | HVXHRTBVIMJUMS-UHFFFAOYSA-N |