4-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)butanamide
Chemical Structure Depiction of
4-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)butanamide
4-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)butanamide
Compound characteristics
Compound ID: | 2159-3349 |
Compound Name: | 4-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)butanamide |
Molecular Weight: | 404.53 |
Molecular Formula: | C17 H16 N4 O2 S3 |
Smiles: | Cc1nnc(NC(CCCN2C(/C(=C/c3ccccc3)SC2=S)=O)=O)s1 |
Stereo: | ACHIRAL |
logP: | 2.4297 |
logD: | 2.3402 |
logSw: | -2.783 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.922 |
InChI Key: | YUQVXVWOGPXZFX-UHFFFAOYSA-N |