3,5-dimethyl-1-[4-(4-methylbenzene-1-sulfonyl)-2-(propane-1-sulfonyl)-1,3-thiazol-5-yl]piperidine
Chemical Structure Depiction of
3,5-dimethyl-1-[4-(4-methylbenzene-1-sulfonyl)-2-(propane-1-sulfonyl)-1,3-thiazol-5-yl]piperidine
3,5-dimethyl-1-[4-(4-methylbenzene-1-sulfonyl)-2-(propane-1-sulfonyl)-1,3-thiazol-5-yl]piperidine
Compound characteristics
Compound ID: | C848-0416 |
Compound Name: | 3,5-dimethyl-1-[4-(4-methylbenzene-1-sulfonyl)-2-(propane-1-sulfonyl)-1,3-thiazol-5-yl]piperidine |
Molecular Weight: | 456.64 |
Molecular Formula: | C20 H28 N2 O4 S3 |
Smiles: | CCCS(c1nc(c(N2CC(C)CC(C)C2)s1)S(c1ccc(C)cc1)(=O)=O)(=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 5.1101 |
logD: | 5.1101 |
logSw: | -4.9716 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 72.471 |
InChI Key: | AVDZCKYEBMJCIM-UHFFFAOYSA-N |