4-[1-(cyclohexanecarbonyl)piperidin-4-yl]-5-cyclopropyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
4-[1-(cyclohexanecarbonyl)piperidin-4-yl]-5-cyclopropyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
4-[1-(cyclohexanecarbonyl)piperidin-4-yl]-5-cyclopropyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S794-0358 |
| Compound Name: | 4-[1-(cyclohexanecarbonyl)piperidin-4-yl]-5-cyclopropyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 332.44 |
| Molecular Formula: | C18 H28 N4 O2 |
| Smiles: | CN1C(N(C2CCN(CC2)C(C2CCCCC2)=O)C(C2CC2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.052 |
| logD: | 3.0478 |
| logSw: | -2.8297 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.49 |
| InChI Key: | WBMLWQDLMMIKTL-UHFFFAOYSA-N |