5-[1-(1-ethyl-1H-pyrazole-3-carbonyl)piperidin-3-yl]-2-methyl-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-[1-(1-ethyl-1H-pyrazole-3-carbonyl)piperidin-3-yl]-2-methyl-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
5-[1-(1-ethyl-1H-pyrazole-3-carbonyl)piperidin-3-yl]-2-methyl-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | P940-4510 |
| Compound Name: | 5-[1-(1-ethyl-1H-pyrazole-3-carbonyl)piperidin-3-yl]-2-methyl-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 380.45 |
| Molecular Formula: | C20 H24 N6 O2 |
| Smiles: | CCn1ccc(C(N2CCCC(C2)C2=NN(C)C(N2c2ccccc2)=O)=O)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6831 |
| logD: | 1.6831 |
| logSw: | -1.6012 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 62.452 |
| InChI Key: | KOAOWQTWFVZGEF-HNNXBMFYSA-N |