4-ethyl-5-{1-[3-(3-methoxyphenyl)propanoyl]piperidin-4-yl}-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
4-ethyl-5-{1-[3-(3-methoxyphenyl)propanoyl]piperidin-4-yl}-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
4-ethyl-5-{1-[3-(3-methoxyphenyl)propanoyl]piperidin-4-yl}-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S559-0151 |
| Compound Name: | 4-ethyl-5-{1-[3-(3-methoxyphenyl)propanoyl]piperidin-4-yl}-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 372.47 |
| Molecular Formula: | C20 H28 N4 O3 |
| Smiles: | CCN1C(C2CCN(CC2)C(CCc2cccc(c2)OC)=O)=NN(C)C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.595 |
| logD: | 2.5941 |
| logSw: | -2.5322 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.757 |
| InChI Key: | SHSLNGXVVLSSSL-UHFFFAOYSA-N |