(furan-2-yl)[3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]methanone
Chemical Structure Depiction of
(furan-2-yl)[3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]methanone
(furan-2-yl)[3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]methanone
Compound characteristics
| Compound ID: | D644-0051 |
| Compound Name: | (furan-2-yl)[3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]methanone |
| Molecular Weight: | 302.25 |
| Molecular Formula: | C13 H13 F3 N2 O3 |
| Smiles: | C1CCC2C(C1)C(C(F)(F)F)(N(C(c1ccco1)=O)N=2)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3307 |
| logD: | 2.3307 |
| logSw: | -2.2921 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.499 |
| InChI Key: | QIVFNYOWEIHRES-UHFFFAOYSA-N |