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121564-33-8

121564-33-8 | Benzenesulfonamide, N-(2-furanylmethyl)-4-methyl-

CAS No: 121564-33-8 Catalog No: AG0015AI MDL No:MFCD00185012

Product Description

Catalog Number:
AG0015AI
Chemical Name:
Benzenesulfonamide, N-(2-furanylmethyl)-4-methyl-
CAS Number:
121564-33-8
Molecular Formula:
C12H13NO3S
Molecular Weight:
251.3015
MDL Number:
MFCD00185012
IUPAC Name:
N-(furan-2-ylmethyl)-4-methylbenzenesulfonamide
InChI:
InChI=1S/C12H13NO3S/c1-10-4-6-12(7-5-10)17(14,15)13-9-11-3-2-8-16-11/h2-8,13H,9H2,1H3
InChI Key:
PYQWNUKIIGGUSD-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)NCc1ccco1

Properties

Complexity:
328  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.062g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
251.3g/mol
Monoisotopic Mass:
251.062g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
67.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Literature

Title Journal
Massive screening yields novel and selective Trypanosoma cruzi triosephosphate isomerase dimer-interface-irreversible inhibitors with anti-trypanosomal activity. European journal of medicinal chemistry 20101201

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