N-{5-[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-2-(4-methylbenzene-1-sulfonyl)acetamide
Chemical Structure Depiction of
N-{5-[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-2-(4-methylbenzene-1-sulfonyl)acetamide
N-{5-[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-2-(4-methylbenzene-1-sulfonyl)acetamide
Compound characteristics
Compound ID: | D294-3664 |
Compound Name: | N-{5-[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-2-(4-methylbenzene-1-sulfonyl)acetamide |
Molecular Weight: | 484.6 |
Molecular Formula: | C23 H24 N4 O4 S2 |
Smiles: | Cc1ccc(cc1)S(CC(Nc1nnc(C2CC(N(C2)c2ccc(C)c(C)c2)=O)s1)=O)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.7839 |
logD: | 3.5924 |
logSw: | -3.7146 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 92.176 |
InChI Key: | GQIQBTBRCURNFD-KRWDZBQOSA-N |