1-(3,4-dimethoxybenzene-1-sulfonyl)-4-(3-methyl-4H-1,2,4-triazol-4-yl)piperidine
Chemical Structure Depiction of
1-(3,4-dimethoxybenzene-1-sulfonyl)-4-(3-methyl-4H-1,2,4-triazol-4-yl)piperidine
1-(3,4-dimethoxybenzene-1-sulfonyl)-4-(3-methyl-4H-1,2,4-triazol-4-yl)piperidine
Compound characteristics
| Compound ID: | P939-4721 |
| Compound Name: | 1-(3,4-dimethoxybenzene-1-sulfonyl)-4-(3-methyl-4H-1,2,4-triazol-4-yl)piperidine |
| Molecular Weight: | 366.44 |
| Molecular Formula: | C16 H22 N4 O4 S |
| Smiles: | Cc1nncn1C1CCN(CC1)S(c1ccc(c(c1)OC)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9476 |
| logD: | 0.9475 |
| logSw: | -2.2798 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.443 |
| InChI Key: | OFVJTAZWCFPERV-UHFFFAOYSA-N |