5-cyclopropyl-4-{1-[(3-methoxyphenyl)methyl]piperidin-4-yl}-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-cyclopropyl-4-{1-[(3-methoxyphenyl)methyl]piperidin-4-yl}-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
5-cyclopropyl-4-{1-[(3-methoxyphenyl)methyl]piperidin-4-yl}-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S794-0517 |
| Compound Name: | 5-cyclopropyl-4-{1-[(3-methoxyphenyl)methyl]piperidin-4-yl}-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 342.44 |
| Molecular Formula: | C19 H26 N4 O2 |
| Smiles: | CN1C(N(C2CCN(CC2)Cc2cccc(c2)OC)C(C2CC2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.08 |
| logD: | 0.7363 |
| logSw: | -3.1012 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.925 |
| InChI Key: | IEYTVHUEIBJMHL-UHFFFAOYSA-N |