3,6,6-trimethyl-1-[4-(trifluoromethoxy)phenyl]-1,5,6,7-tetrahydro-4H-indazol-4-one
Chemical Structure Depiction of
3,6,6-trimethyl-1-[4-(trifluoromethoxy)phenyl]-1,5,6,7-tetrahydro-4H-indazol-4-one
3,6,6-trimethyl-1-[4-(trifluoromethoxy)phenyl]-1,5,6,7-tetrahydro-4H-indazol-4-one
Compound characteristics
| Compound ID: | 8012-5934 |
| Compound Name: | 3,6,6-trimethyl-1-[4-(trifluoromethoxy)phenyl]-1,5,6,7-tetrahydro-4H-indazol-4-one |
| Molecular Weight: | 338.33 |
| Molecular Formula: | C17 H17 F3 N2 O2 |
| Smiles: | Cc1c2C(CC(C)(C)Cc2n(c2ccc(cc2)OC(F)(F)F)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8682 |
| logD: | 3.8682 |
| logSw: | -4.453 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.746 |
| InChI Key: | FOUAOBAEUKHQNX-UHFFFAOYSA-N |