4-(4-methylphenyl)-5-[1-(6-methylpyridine-3-carbonyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
4-(4-methylphenyl)-5-[1-(6-methylpyridine-3-carbonyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
4-(4-methylphenyl)-5-[1-(6-methylpyridine-3-carbonyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S383-2402 |
| Compound Name: | 4-(4-methylphenyl)-5-[1-(6-methylpyridine-3-carbonyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 377.44 |
| Molecular Formula: | C21 H23 N5 O2 |
| Smiles: | Cc1ccc(cc1)N1C(C2CCN(CC2)C(c2ccc(C)nc2)=O)=NNC1=O |
| Stereo: | ACHIRAL |
| logP: | 2.5752 |
| logD: | 2.5517 |
| logSw: | -2.6848 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.728 |
| InChI Key: | AEHFSRSXLJBSOW-UHFFFAOYSA-N |