1-(3,4-dimethylbenzene-1-sulfonyl)-4-[3-(2-methoxyethyl)-4H-1,2,4-triazol-4-yl]piperidine
Chemical Structure Depiction of
1-(3,4-dimethylbenzene-1-sulfonyl)-4-[3-(2-methoxyethyl)-4H-1,2,4-triazol-4-yl]piperidine
1-(3,4-dimethylbenzene-1-sulfonyl)-4-[3-(2-methoxyethyl)-4H-1,2,4-triazol-4-yl]piperidine
Compound characteristics
| Compound ID: | P939-3478 |
| Compound Name: | 1-(3,4-dimethylbenzene-1-sulfonyl)-4-[3-(2-methoxyethyl)-4H-1,2,4-triazol-4-yl]piperidine |
| Molecular Weight: | 378.49 |
| Molecular Formula: | C18 H26 N4 O3 S |
| Smiles: | Cc1ccc(cc1C)S(N1CCC(CC1)n1cnnc1CCOC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4159 |
| logD: | 2.4159 |
| logSw: | -2.506 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.724 |
| InChI Key: | VAILQOIJWCAQKE-UHFFFAOYSA-N |