C14H12BrNO4S2

3-[(5E)-5-[(3-bromo-4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

Also Known As: BAS 01292936|chemical diversity library compound 11|BIM-0039273.P001|3-{5-[(3-bromo-4-methoxyphenyl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl} propanoic acid|3-[(5E)-5-[(3-bromo-4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid|(E)-3-(5-(3-bromo-4-methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid|3-[5-(3-Bromo-4-methoxy-benzylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]-propionic|3-[(5E)-5-(3-bromo-4-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid

Molecular Formula	C14H12BrNO4S2
Molecular Weight	400.93912 g/mol
LogP	3.1336
Topological Polar Surface Area	66.84 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	5
Exact Mass	400.93912
Monoisotopic Mass	400.93912
Heavy Atoms	22
Complexity	674.8067

Chemical Identifiers

CAS Number	305375-29-5
SMILES	COC1=C(C=C(C=C1)/C=C/2\C(=O)N(C(=S)S2)CCC(=O)O)Br