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Home Other Building Blocks 3-Diethylsulfamoylbenzoic acid

3-Diethylsulfamoylbenzoic acid

CAS No.:
1576-46-1
Catalog Number:
AG001PK3
Molecular Formula:
C11H15NO4S
Molecular Weight:
257.3061
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$63
- +
5g
97%
In Stock USA
United States
$188
- +
10g
97%
In Stock USA
United States
$313
- +
25g
97%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG001PK3
Chemical Name:
3-Diethylsulfamoylbenzoic acid
CAS Number:
1576-46-1
Molecular Formula:
C11H15NO4S
Molecular Weight:
257.3061
MDL Number:
MFCD00760900
IUPAC Name:
3-(diethylsulfamoyl)benzoic acid
InChI:
InChI=1S/C11H15NO4S/c1-3-12(4-2)17(15,16)10-7-5-6-9(8-10)11(13)14/h5-8H,3-4H2,1-2H3,(H,13,14)
InChI Key:
BIXIGFOEUQAXDL-UHFFFAOYSA-N
SMILES:
CCN(S(=O)(=O)c1cccc(c1)C(=O)O)CC
Properties
Complexity:
356  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.072g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
257.304g/mol
Monoisotopic Mass:
257.072g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties