sales@angenesci.com
Login | Register
logo
Structures Search
Home Sulfos Alpha-toluenesulfonamide

Alpha-toluenesulfonamide

CAS No.:
4563-33-1
Catalog Number:
AG0035Y3
Molecular Formula:
C7H9NO2S
Molecular Weight:
171.2169
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$30
- +
5g
98%
In Stock USA
United States
$90
- +
10g
98%
In Stock USA
United States
$150
- +
25g
98%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG0035Y3
Chemical Name:
Alpha-toluenesulfonamide
CAS Number:
4563-33-1
Molecular Formula:
C7H9NO2S
Molecular Weight:
171.2169
MDL Number:
MFCD00041893
IUPAC Name:
phenylmethanesulfonamide
InChI:
InChI=1S/C7H9NO2S/c8-11(9,10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,8,9,10)
InChI Key:
ABOYDMHGKWRPFD-UHFFFAOYSA-N
SMILES:
NS(=O)(=O)Cc1ccccc1
EC Number:
224-935-0
NSC Number:
28899
Properties
Complexity:
199  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.035g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
171.214g/mol
Monoisotopic Mass:
171.035g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Literature
Title Journal
Divergent effects of compounds on the hydrolysis and transpeptidation reactions of γ-glutamyl transpeptidase. Journal of enzyme inhibition and medicinal chemistry 20120801
Benzyl-sulfamide. Acta crystallographica. Section E, Structure reports online 20110601
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Indole cytosolic phospholipase A2 alpha inhibitors: discovery and in vitro and in vivo characterization of 4-{3-[5-chloro-2-(2-{[(3,4-dichlorobenzyl)sulfonyl]amino}ethyl)-1-(diphenylmethyl)-1H-indol-3-yl]propyl}benzoic acid, efipladib. Journal of medicinal chemistry 20080626
Discovery of Ecopladib, an indole inhibitor of cytosolic phospholipase A2alpha. Journal of medicinal chemistry 20070322
Carbonic anhydrase inhibitors: inhibition of the human isozymes I, II, VA, and IX with a library of substituted difluoromethanesulfonamides. Bioorganic & medicinal chemistry letters 20051201
Benzimidazole derivatives as novel nonpeptide luteinizing hormone-releasing hormone (LHRH) antagonists. Part 2: Benzimidazole-5-sulfonamides. Bioorganic & medicinal chemistry letters 20050201
Properties