1-[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(5-phenyl-2H-tetrazol-2-yl)ethan-1-one
Chemical Structure Depiction of
1-[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(5-phenyl-2H-tetrazol-2-yl)ethan-1-one
1-[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(5-phenyl-2H-tetrazol-2-yl)ethan-1-one
Compound characteristics
| Compound ID: | Y503-1233 |
| Compound Name: | 1-[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(5-phenyl-2H-tetrazol-2-yl)ethan-1-one |
| Molecular Weight: | 340.26 |
| Molecular Formula: | C13 H11 F3 N6 O2 |
| Smiles: | C1C=NN(C(Cn2nc(c3ccccc3)nn2)=O)C1(C(F)(F)F)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8577 |
| logD: | 0.8577 |
| logSw: | -1.6261 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.191 |
| InChI Key: | AKZWMYHOXBEQQG-LBPRGKRZSA-N |