Home Aminos 4-[(4-methyl-1,3-thiazol-2-yl)amino]benzoic acid

4-[(4-methyl-1,3-thiazol-2-yl)amino]benzoic acid

CAS No.:
33942-54-0
Catalog Number:
AG019RC6
Molecular Formula:
C11H10N2O2S
Molecular Weight:
234.2743
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Product Description
Catalog Number:
AG019RC6
Chemical Name:
4-[(4-methyl-1,3-thiazol-2-yl)amino]benzoic acid
CAS Number:
33942-54-0
Molecular Formula:
C11H10N2O2S
Molecular Weight:
234.2743
MDL Number:
MFCD02946200
IUPAC Name:
4-[(4-methyl-1,3-thiazol-2-yl)amino]benzoic acid
InChI:
InChI=1S/C11H10N2O2S/c1-7-6-16-11(12-7)13-9-4-2-8(3-5-9)10(14)15/h2-6H,1H3,(H,12,13)(H,14,15)
InChI Key:
VWQMNWDBMGYALO-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)Nc1scc(n1)C
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.046g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
234.273g/mol
Monoisotopic Mass:
234.046g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
90.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
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