3-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(5-methyl-1,2-oxazol-3-yl)propanamide
Chemical Structure Depiction of
3-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(5-methyl-1,2-oxazol-3-yl)propanamide
3-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(5-methyl-1,2-oxazol-3-yl)propanamide
Compound characteristics
Compound ID: | 3793-4541 |
Compound Name: | 3-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-(5-methyl-1,2-oxazol-3-yl)propanamide |
Molecular Weight: | 452.35 |
Molecular Formula: | C17 H14 Br N3 O3 S2 |
Smiles: | Cc1cc(NC(CCN2C(/C(=C\c3cccc(c3)[Br])SC2=S)=O)=O)no1 |
Stereo: | ACHIRAL |
logP: | 4.008 |
logD: | 3.9354 |
logSw: | -4.0885 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.366 |
InChI Key: | VPBLRMKQICUPKH-UHFFFAOYSA-N |