N~1~-{5-[(butan-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-N~2~-(propan-2-yl)ethanediamide
Chemical Structure Depiction of
N~1~-{5-[(butan-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-N~2~-(propan-2-yl)ethanediamide
N~1~-{5-[(butan-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-N~2~-(propan-2-yl)ethanediamide
Compound characteristics
Compound ID: | Y032-4692 |
Compound Name: | N~1~-{5-[(butan-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-N~2~-(propan-2-yl)ethanediamide |
Molecular Weight: | 302.41 |
Molecular Formula: | C11 H18 N4 O2 S2 |
Smiles: | CCC(C)Sc1nnc(NC(C(NC(C)C)=O)=O)s1 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.6965 |
logD: | 0.2274 |
logSw: | -2.9958 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 70.166 |
InChI Key: | MEIZWHZBFJTKBE-ZETCQYMHSA-N |