2-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-N-(5-butyl-1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
2-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-N-(5-butyl-1,3,4-thiadiazol-2-yl)acetamide
2-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-N-(5-butyl-1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
Compound ID: | 2389-1248 |
Compound Name: | 2-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-N-(5-butyl-1,3,4-thiadiazol-2-yl)acetamide |
Molecular Weight: | 418.56 |
Molecular Formula: | C18 H18 N4 O2 S3 |
Smiles: | CCCCc1nnc(NC(CN2C(/C(=C\c3ccccc3)SC2=S)=O)=O)s1 |
Stereo: | ACHIRAL |
logP: | 4.3899 |
logD: | 4.3577 |
logSw: | -4.142 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.632 |
InChI Key: | CTLQZEGMFHNWLM-JLHYYAGUSA-N |