AC1LR9W2

2-[(5E)-5-[(4-benzoyloxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid

Also Known As: BAS 00478390|AB00088843-01|(E)-2-(5-(4-(benzoyloxy)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)acetic acid|[(5E)-4-oxo-5-{4-[(phenylcarbonyl)oxy]benzylidene}-2-thioxo-1,3-thiazolidin-3-yl]acetic acid|2-[(5E)-5-[(4-benzoyloxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid|2-{4-oxo-5-[(4-phenylcarbonyloxyphenyl)methylene]-2-thioxo-1,3-thiazolidin-3-y l}acetic acid

Molecular Formula	C19H13NO5S2
Molecular Weight	399.02353 g/mol
LogP	3.1916
Topological Polar Surface Area	83.91 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	5
Exact Mass	399.02353
Monoisotopic Mass	399.02353
Heavy Atoms	27
Complexity	938.3322

Chemical Identifiers

CAS Number	333393-30-9
SMILES	C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=C/3\C(=O)N(C(=S)S3)CC(=O)O