N-{5-[1-(4-ethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-3,4-dimethylbenzamide
Chemical Structure Depiction of
N-{5-[1-(4-ethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-3,4-dimethylbenzamide
N-{5-[1-(4-ethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-3,4-dimethylbenzamide
Compound characteristics
Compound ID: | D294-1053 |
Compound Name: | N-{5-[1-(4-ethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-3,4-dimethylbenzamide |
Molecular Weight: | 420.53 |
Molecular Formula: | C23 H24 N4 O2 S |
Smiles: | CCc1ccc(cc1)N1CC(CC1=O)c1nnc(NC(c2ccc(C)c(C)c2)=O)s1 |
Stereo: | RACEMIC MIXTURE |
logP: | 5.0873 |
logD: | 3.5372 |
logSw: | -4.7859 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.353 |
InChI Key: | PYVRJJIWCQHSKM-SFHVURJKSA-N |