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Home Sulfos 3-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide

3-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide

CAS No.:
326873-69-2
Catalog Number:
AG019J4V
Molecular Formula:
C7H7N5O2S
Molecular Weight:
225.2278
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Product Description
Catalog Number:
AG019J4V
Chemical Name:
3-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide
CAS Number:
326873-69-2
Molecular Formula:
C7H7N5O2S
Molecular Weight:
225.2278
MDL Number:
MFCD02703570
IUPAC Name:
3-(tetrazol-1-yl)benzenesulfonamide
InChI:
InChI=1S/C7H7N5O2S/c8-15(13,14)7-3-1-2-6(4-7)12-5-9-10-11-12/h1-5H,(H2,8,13,14)
InChI Key:
KKCJRXVQNYBUFW-UHFFFAOYSA-N
SMILES:
NS(=O)(=O)c1cccc(c1)n1cnnn1
Properties
Complexity:
314  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.032g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.226g/mol
Monoisotopic Mass:
225.032g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
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