CAS 103788-60-9 | 2,4-Thiazolidinedione, 5-[(4-hydroxyphenyl)methylene]- | CAS Number 103788-60-9

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103788-60-9 | 2,4-Thiazolidinedione, 5-[(4-hydroxyphenyl)methylene]-

CAS No: 103788-60-9 Catalog No: AG00976U MDL No:MFCD00640639

Product Description

Catalog Number:

AG00976U

Chemical Name:

2,4-Thiazolidinedione, 5-[(4-hydroxyphenyl)methylene]-

CAS Number:

103788-60-9

Molecular Formula:

C10H7NO3S

Molecular Weight:

221.2325

MDL Number:

MFCD00640639

IUPAC Name:

(5E)-5-[(4-hydroxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione

InChI:

InChI=1S/C10H7NO3S/c12-7-3-1-6(2-4-7)5-8-9(13)11-10(14)15-8/h1-5,12H,(H,11,13,14)/b8-5+

InChI Key:

ARHIHDVVUHVQCP-VMPITWQZSA-N

SMILES:

O=C1NC(=O)S/C/1=C/c1ccc(cc1)O

Properties

Complexity:

319

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

221.015g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

221.23g/mol

Monoisotopic Mass:

221.015g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

91.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8

Literature

Title	Journal
Synthesis of O-prenylated and O-geranylated derivatives of 5-benzylidene2,4-thiazolidinediones and evaluation of their free radical scavenging activity as well as effect on some phase II antioxidant/detoxifying enzymes.	Bioorganic & medicinal chemistry letters 20070301