4-[3-(trifluoromethyl)-5,6,7,8-tetrahydrocyclohepta[c]pyrazol-1(4H)-yl]butanoic acid
Chemical Structure Depiction of
4-[3-(trifluoromethyl)-5,6,7,8-tetrahydrocyclohepta[c]pyrazol-1(4H)-yl]butanoic acid
4-[3-(trifluoromethyl)-5,6,7,8-tetrahydrocyclohepta[c]pyrazol-1(4H)-yl]butanoic acid
Compound characteristics
| Compound ID: | Y503-2312 |
| Compound Name: | 4-[3-(trifluoromethyl)-5,6,7,8-tetrahydrocyclohepta[c]pyrazol-1(4H)-yl]butanoic acid |
| Molecular Weight: | 290.28 |
| Molecular Formula: | C13 H17 F3 N2 O2 |
| Smiles: | C1CCc2c(C(F)(F)F)nn(CCCC(O)=O)c2CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.0529 |
| logD: | -0.6662 |
| logSw: | -1.9835 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.584 |
| InChI Key: | MRDPUIPVAFRUGL-UHFFFAOYSA-N |