2-(5-phenyl-4H-1,2,4-triazol-3-yl)-1-(propane-1-sulfonyl)piperidine
Chemical Structure Depiction of
2-(5-phenyl-4H-1,2,4-triazol-3-yl)-1-(propane-1-sulfonyl)piperidine
2-(5-phenyl-4H-1,2,4-triazol-3-yl)-1-(propane-1-sulfonyl)piperidine
Compound characteristics
Compound ID: | M754-1235 |
Compound Name: | 2-(5-phenyl-4H-1,2,4-triazol-3-yl)-1-(propane-1-sulfonyl)piperidine |
Molecular Weight: | 334.44 |
Molecular Formula: | C16 H22 N4 O2 S |
Smiles: | CCCS(N1CCCCC1c1nnc(c2ccccc2)[nH]1)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.2505 |
logD: | 2.2147 |
logSw: | -2.5398 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.099 |
InChI Key: | GBXFGHWKXSNKIG-AWEZNQCLSA-N |