5-[1-(1,5-dimethyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-[1-(1,5-dimethyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
5-[1-(1,5-dimethyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S559-1353 |
| Compound Name: | 5-[1-(1,5-dimethyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 346.43 |
| Molecular Formula: | C17 H26 N6 O2 |
| Smiles: | CC(C)N1C(C2CCN(CC2)C(c2cc(C)n(C)n2)=O)=NN(C)C1=O |
| Stereo: | ACHIRAL |
| logP: | 1.188 |
| logD: | 1.1817 |
| logSw: | -1.4777 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 63.224 |
| InChI Key: | CZRSVHLFBNWYDL-UHFFFAOYSA-N |