1-(4-chloro-3-methylbenzene-1-sulfonyl)-4-[3-(methoxymethyl)-4H-1,2,4-triazol-4-yl]piperidine
Chemical Structure Depiction of
1-(4-chloro-3-methylbenzene-1-sulfonyl)-4-[3-(methoxymethyl)-4H-1,2,4-triazol-4-yl]piperidine
1-(4-chloro-3-methylbenzene-1-sulfonyl)-4-[3-(methoxymethyl)-4H-1,2,4-triazol-4-yl]piperidine
Compound characteristics
| Compound ID: | P939-5123 |
| Compound Name: | 1-(4-chloro-3-methylbenzene-1-sulfonyl)-4-[3-(methoxymethyl)-4H-1,2,4-triazol-4-yl]piperidine |
| Molecular Weight: | 384.88 |
| Molecular Formula: | C16 H21 Cl N4 O3 S |
| Smiles: | Cc1cc(ccc1[Cl])S(N1CCC(CC1)n1cnnc1COC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4172 |
| logD: | 2.4171 |
| logSw: | -3.0245 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.806 |
| InChI Key: | FSQNUEIGGSORRV-UHFFFAOYSA-N |