[3-hydroxy-3-(trifluoromethyl)-3a,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-2(3H)-yl](thiophen-2-yl)methanone
Chemical Structure Depiction of
[3-hydroxy-3-(trifluoromethyl)-3a,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-2(3H)-yl](thiophen-2-yl)methanone
[3-hydroxy-3-(trifluoromethyl)-3a,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-2(3H)-yl](thiophen-2-yl)methanone
Compound characteristics
Compound ID: | 7853-0024 |
Compound Name: | [3-hydroxy-3-(trifluoromethyl)-3a,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-2(3H)-yl](thiophen-2-yl)methanone |
Molecular Weight: | 332.34 |
Molecular Formula: | C14 H15 F3 N2 O2 S |
Smiles: | C1CCC2C(CC1)=NN(C(c1cccs1)=O)C2(C(F)(F)F)O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.5461 |
logD: | 3.5461 |
logSw: | -3.5547 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 44.27 |
InChI Key: | PWHKJFMVDGDDMU-UHFFFAOYSA-N |