1-[3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-2-(2,4,6-trimethylphenoxy)ethan-1-one
Chemical Structure Depiction of
1-[3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-2-(2,4,6-trimethylphenoxy)ethan-1-one
1-[3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-2-(2,4,6-trimethylphenoxy)ethan-1-one
Compound characteristics
| Compound ID: | 4607-0204 |
| Compound Name: | 1-[3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-2-(2,4,6-trimethylphenoxy)ethan-1-one |
| Molecular Weight: | 384.4 |
| Molecular Formula: | C19 H23 F3 N2 O3 |
| Smiles: | Cc1cc(C)c(c(C)c1)OCC(N1C(C2CCCCC2=N1)(C(F)(F)F)O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.416 |
| logD: | 4.4154 |
| logSw: | -4.167 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.066 |
| InChI Key: | IGDWWHFQEPTYES-UHFFFAOYSA-N |