3-(4-methoxyphenyl)-2-[4-(trifluoromethyl)phenyl]tetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-one
Chemical Structure Depiction of
3-(4-methoxyphenyl)-2-[4-(trifluoromethyl)phenyl]tetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-one
3-(4-methoxyphenyl)-2-[4-(trifluoromethyl)phenyl]tetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-one
Compound characteristics
| Compound ID: | C614-5901 |
| Compound Name: | 3-(4-methoxyphenyl)-2-[4-(trifluoromethyl)phenyl]tetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-one |
| Molecular Weight: | 377.36 |
| Molecular Formula: | C19 H18 F3 N3 O2 |
| Smiles: | COc1ccc(cc1)C1N(C(N2CCCN12)=O)c1ccc(cc1)C(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0877 |
| logD: | 4.0877 |
| logSw: | -4.2144 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.7838 |
| InChI Key: | IXJMOYCXRJUZLD-KRWDZBQOSA-N |