5-[1-(2,6-dimethoxypyridine-3-carbonyl)piperidin-4-yl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-[1-(2,6-dimethoxypyridine-3-carbonyl)piperidin-4-yl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
5-[1-(2,6-dimethoxypyridine-3-carbonyl)piperidin-4-yl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S383-2224 |
| Compound Name: | 5-[1-(2,6-dimethoxypyridine-3-carbonyl)piperidin-4-yl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 409.44 |
| Molecular Formula: | C21 H23 N5 O4 |
| Smiles: | COc1ccc(C(N2CCC(CC2)C2=NNC(N2c2ccccc2)=O)=O)c(n1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.9717 |
| logD: | 2.9484 |
| logSw: | -3.2776 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.145 |
| InChI Key: | NZYQGFKNNPMIQU-UHFFFAOYSA-N |