Home Other Building Blocks sodium 2-[2-(3-phenoxyphenyl)-1,3-thiazol-4-yl]acetate

sodium 2-[2-(3-phenoxyphenyl)-1,3-thiazol-4-yl]acetate

CAS No.:
1007016-49-0
Catalog Number:
AG019JRE
Molecular Formula:
C17H12NNaO3S
Molecular Weight:
333.3369
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Product Description
Catalog Number:
AG019JRE
Chemical Name:
sodium 2-[2-(3-phenoxyphenyl)-1,3-thiazol-4-yl]acetate
CAS Number:
1007016-49-0
Molecular Formula:
C17H12NNaO3S
Molecular Weight:
333.3369
MDL Number:
MFCD07288347
IUPAC Name:
sodium;2-[2-(3-phenoxyphenyl)-1,3-thiazol-4-yl]acetate
InChI:
InChI=1S/C17H13NO3S.Na/c19-16(20)10-13-11-22-17(18-13)12-5-4-8-15(9-12)21-14-6-2-1-3-7-14;/h1-9,11H,10H2,(H,19,20);/q;+1/p-1
InChI Key:
HOKQEQWPZCJPGM-UHFFFAOYSA-M
SMILES:
[O-]C(=O)Cc1csc(n1)c1cccc(c1)Oc1ccccc1.[Na+]
Properties
Complexity:
379  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.044g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
333.337g/mol
Monoisotopic Mass:
333.044g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
90.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties