5-cyclopropyl-4-[1-(furan-2-carbonyl)piperidin-4-yl]-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-cyclopropyl-4-[1-(furan-2-carbonyl)piperidin-4-yl]-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
5-cyclopropyl-4-[1-(furan-2-carbonyl)piperidin-4-yl]-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S794-0434 |
| Compound Name: | 5-cyclopropyl-4-[1-(furan-2-carbonyl)piperidin-4-yl]-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 316.36 |
| Molecular Formula: | C16 H20 N4 O3 |
| Smiles: | CN1C(N(C2CCN(CC2)C(c2ccco2)=O)C(C2CC2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8446 |
| logD: | 1.8403 |
| logSw: | -1.5872 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.876 |
| InChI Key: | PBXPJSPVIWTNKB-UHFFFAOYSA-N |