2,5-dimethyl-4-[1-(pyridine-3-sulfonyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
2,5-dimethyl-4-[1-(pyridine-3-sulfonyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
2,5-dimethyl-4-[1-(pyridine-3-sulfonyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S794-0286 |
| Compound Name: | 2,5-dimethyl-4-[1-(pyridine-3-sulfonyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 337.4 |
| Molecular Formula: | C14 H19 N5 O3 S |
| Smiles: | CC1=NN(C)C(N1C1CCN(CC1)S(c1cccnc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8663 |
| logD: | 0.8663 |
| logSw: | -1.4477 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.391 |
| InChI Key: | DCWBFLFQDIDDLU-UHFFFAOYSA-N |