4-ethyl-5-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
4-ethyl-5-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
4-ethyl-5-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S559-0065 |
| Compound Name: | 4-ethyl-5-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 344.41 |
| Molecular Formula: | C18 H24 N4 O3 |
| Smiles: | CCN1C(C2CCN(CC2)C(c2cccc(c2)OC)=O)=NN(C)C1=O |
| Stereo: | ACHIRAL |
| logP: | 1.9856 |
| logD: | 1.9847 |
| logSw: | -2.1438 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.285 |
| InChI Key: | QKTIKCYHDAJOEU-UHFFFAOYSA-N |