2-(2,6-dimethylphenyl)-3-(4-fluorophenyl)tetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-one
Chemical Structure Depiction of
2-(2,6-dimethylphenyl)-3-(4-fluorophenyl)tetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-one
2-(2,6-dimethylphenyl)-3-(4-fluorophenyl)tetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-one
Compound characteristics
| Compound ID: | C614-5920 |
| Compound Name: | 2-(2,6-dimethylphenyl)-3-(4-fluorophenyl)tetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-one |
| Molecular Weight: | 325.38 |
| Molecular Formula: | C19 H20 F N3 O |
| Smiles: | Cc1cccc(C)c1N1C(c2ccc(cc2)F)N2CCCN2C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9829 |
| logD: | 3.9829 |
| logSw: | -4.02 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 22.6381 |
| InChI Key: | PRHWKSJBLUVYSE-SFHVURJKSA-N |