2-(4-chlorophenyl)-3-(4-methylphenyl)tetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-3-(4-methylphenyl)tetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-one
2-(4-chlorophenyl)-3-(4-methylphenyl)tetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-one
Compound characteristics
| Compound ID: | 8016-3348 |
| Compound Name: | 2-(4-chlorophenyl)-3-(4-methylphenyl)tetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-one |
| Molecular Weight: | 327.81 |
| Molecular Formula: | C18 H18 Cl N3 O |
| Smiles: | Cc1ccc(cc1)C1N(C(N2CCCN12)=O)c1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2507 |
| logD: | 4.2507 |
| logSw: | -4.7187 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 23.24 |
| InChI Key: | AXKJDISEYVHZNG-KRWDZBQOSA-N |