5-cyclopropyl-2-methyl-4-[1-(phenoxyacetyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-cyclopropyl-2-methyl-4-[1-(phenoxyacetyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
5-cyclopropyl-2-methyl-4-[1-(phenoxyacetyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S794-0431 |
| Compound Name: | 5-cyclopropyl-2-methyl-4-[1-(phenoxyacetyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 356.42 |
| Molecular Formula: | C19 H24 N4 O3 |
| Smiles: | CN1C(N(C2CCN(CC2)C(COc2ccccc2)=O)C(C2CC2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1803 |
| logD: | 2.176 |
| logSw: | -2.0534 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.269 |
| InChI Key: | ICQGUCSPNBCUAD-UHFFFAOYSA-N |