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Home Other Building Blocks 3-[ethyl(phenyl)sulfamoyl]benzoic acid

3-[ethyl(phenyl)sulfamoyl]benzoic acid

CAS No.:
325721-87-7
Catalog Number:
AG019GLB
Molecular Formula:
C15H15NO4S
Molecular Weight:
305.3489
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Product Description
Catalog Number:
AG019GLB
Chemical Name:
3-[ethyl(phenyl)sulfamoyl]benzoic acid
CAS Number:
325721-87-7
Molecular Formula:
C15H15NO4S
Molecular Weight:
305.3489
MDL Number:
MFCD02711591
IUPAC Name:
3-[ethyl(phenyl)sulfamoyl]benzoic acid
InChI:
InChI=1S/C15H15NO4S/c1-2-16(13-8-4-3-5-9-13)21(19,20)14-10-6-7-12(11-14)15(17)18/h3-11H,2H2,1H3,(H,17,18)
InChI Key:
NZRQFMPFEUTMTQ-UHFFFAOYSA-N
SMILES:
CCN(S(=O)(=O)c1cccc(c1)C(=O)O)c1ccccc1
Properties
Complexity:
451  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.072g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
305.348g/mol
Monoisotopic Mass:
305.072g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
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