1-(3,4-dimethoxybenzene-1-sulfonyl)-4-(3-phenyl-4H-1,2,4-triazol-4-yl)piperidine
Chemical Structure Depiction of
1-(3,4-dimethoxybenzene-1-sulfonyl)-4-(3-phenyl-4H-1,2,4-triazol-4-yl)piperidine
1-(3,4-dimethoxybenzene-1-sulfonyl)-4-(3-phenyl-4H-1,2,4-triazol-4-yl)piperidine
Compound characteristics
| Compound ID: | P939-4305 |
| Compound Name: | 1-(3,4-dimethoxybenzene-1-sulfonyl)-4-(3-phenyl-4H-1,2,4-triazol-4-yl)piperidine |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C21 H24 N4 O4 S |
| Smiles: | COc1ccc(cc1OC)S(N1CCC(CC1)n1cnnc1c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7663 |
| logD: | 2.7663 |
| logSw: | -3.1926 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.395 |
| InChI Key: | YCLFDUYHVWNLFN-UHFFFAOYSA-N |