1-(2,3-dimethylphenyl)-5-oxo-N-[5-(pentan-2-yl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide
Chemical Structure Depiction of
1-(2,3-dimethylphenyl)-5-oxo-N-[5-(pentan-2-yl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide
1-(2,3-dimethylphenyl)-5-oxo-N-[5-(pentan-2-yl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide
Compound characteristics
Compound ID: | Y031-3682 |
Compound Name: | 1-(2,3-dimethylphenyl)-5-oxo-N-[5-(pentan-2-yl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide |
Molecular Weight: | 386.51 |
Molecular Formula: | C20 H26 N4 O2 S |
Smiles: | CCCC(C)c1nnc(NC(C2CC(N(C2)c2cccc(C)c2C)=O)=O)s1 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.162 |
logD: | 3.5816 |
logSw: | -4.0201 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.324 |
InChI Key: | RSWQDMNXMXSTNJ-UHFFFAOYSA-N |