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Home Sulfos 4-Amino-n-[4-(trifluoromethyl)phenyl]benzenesulfonamide

4-Amino-n-[4-(trifluoromethyl)phenyl]benzenesulfonamide

CAS No.:
339-42-4
Catalog Number:
AG00CARC
Molecular Formula:
C13H11F3N2O2S
Molecular Weight:
316.2988
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
98%
In Stock USA
United States
$75
- +
250mg
98%
In Stock USA
United States
$144
- +
1g
98%
In Stock USA
United States
$319
- +
Product Description
Catalog Number:
AG00CARC
Chemical Name:
4-Amino-n-[4-(trifluoromethyl)phenyl]benzenesulfonamide
CAS Number:
339-42-4
Molecular Formula:
C13H11F3N2O2S
Molecular Weight:
316.2988
MDL Number:
MFCD01935804
IUPAC Name:
4-amino-N-[4-(trifluoromethyl)phenyl]benzenesulfonamide
InChI:
InChI=1S/C13H11F3N2O2S/c14-13(15,16)9-1-5-11(6-2-9)18-21(19,20)12-7-3-10(17)4-8-12/h1-8,18H,17H2
InChI Key:
VRMCQOJYBYDIHX-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)C(F)(F)F
Properties
Complexity:
431  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.049g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
316.298g/mol
Monoisotopic Mass:
316.049g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Literature
Title Journal
Design and synthesis of benzenesulfonanilides active against methicillin-resistant Staphylococcus aureus and vancomycin-resistant Enterococcus. Bioorganic & medicinal chemistry 20080601
Analgesic agents without gastric damage: design and synthesis of structurally simple benzenesulfonanilide-type cyclooxygenase-1-selective inhibitors. Bioorganic & medicinal chemistry 20070115
Properties