1-(3-fluoro-4-methylbenzene-1-sulfonyl)-4-[3-(methoxymethyl)-4H-1,2,4-triazol-4-yl]piperidine
Chemical Structure Depiction of
1-(3-fluoro-4-methylbenzene-1-sulfonyl)-4-[3-(methoxymethyl)-4H-1,2,4-triazol-4-yl]piperidine
1-(3-fluoro-4-methylbenzene-1-sulfonyl)-4-[3-(methoxymethyl)-4H-1,2,4-triazol-4-yl]piperidine
Compound characteristics
Compound ID: | P939-5125 |
Compound Name: | 1-(3-fluoro-4-methylbenzene-1-sulfonyl)-4-[3-(methoxymethyl)-4H-1,2,4-triazol-4-yl]piperidine |
Molecular Weight: | 368.43 |
Molecular Formula: | C16 H21 F N4 O3 S |
Smiles: | Cc1ccc(cc1F)S(N1CCC(CC1)n1cnnc1COC)(=O)=O |
Stereo: | ACHIRAL |
logP: | 1.8055 |
logD: | 1.8054 |
logSw: | -2.5298 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 65.806 |
InChI Key: | MJRGSEWAOZAJEL-UHFFFAOYSA-N |