5-{1-[(3-methoxyphenyl)acetyl]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-[(3-methoxyphenyl)acetyl]piperidin-4-yl}-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
5-{1-[(3-methoxyphenyl)acetyl]piperidin-4-yl}-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S559-1241 |
| Compound Name: | 5-{1-[(3-methoxyphenyl)acetyl]piperidin-4-yl}-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 372.47 |
| Molecular Formula: | C20 H28 N4 O3 |
| Smiles: | CC(C)N1C(C2CCN(CC2)C(Cc2cccc(c2)OC)=O)=NN(C)C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.7503 |
| logD: | 2.7441 |
| logSw: | -2.8606 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.753 |
| InChI Key: | PDLQFBVNNODQAY-UHFFFAOYSA-N |