4-[1-(furan-2-carbonyl)piperidin-4-yl]-2,5-dimethyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
4-[1-(furan-2-carbonyl)piperidin-4-yl]-2,5-dimethyl-2,4-dihydro-3H-1,2,4-triazol-3-one
4-[1-(furan-2-carbonyl)piperidin-4-yl]-2,5-dimethyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S794-0107 |
| Compound Name: | 4-[1-(furan-2-carbonyl)piperidin-4-yl]-2,5-dimethyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 290.32 |
| Molecular Formula: | C14 H18 N4 O3 |
| Smiles: | CC1=NN(C)C(N1C1CCN(CC1)C(c1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0924 |
| logD: | 1.0923 |
| logSw: | -1.2772 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.388 |
| InChI Key: | DWXKJTPSQHRKKG-UHFFFAOYSA-N |