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127378-19-2

127378-19-2 | 4-Thiazolidinone, 5-[(3-fluoro-4-methoxyphenyl)methylene]-2-thioxo-

CAS No: 127378-19-2 Catalog No: AG000X0N MDL No:

Product Description

Catalog Number:
AG000X0N
Chemical Name:
4-Thiazolidinone, 5-[(3-fluoro-4-methoxyphenyl)methylene]-2-thioxo-
CAS Number:
127378-19-2
Molecular Formula:
C11H8FNO2S2
Molecular Weight:
269.3151
IUPAC Name:
5-[(3-fluoro-4-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
InChI:
InChI=1S/C11H8FNO2S2/c1-15-8-3-2-6(4-7(8)12)5-9-10(14)13-11(16)17-9/h2-5H,1H3,(H,13,14,16)
InChI Key:
KVOSQTFRHINPKZ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1F)C=C1SC(=S)NC1=O

Properties

Complexity:
373  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.998g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
269.308g/mol
Monoisotopic Mass:
268.998g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
95.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.9  

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