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Home Sulfos N-(3-chloroquinoxalin-2-yl)-2-(trifluoromethyl)benzene-1-sulfonamide

N-(3-chloroquinoxalin-2-yl)-2-(trifluoromethyl)benzene-1-sulfonamide

CAS No.:
877964-71-1
Catalog Number:
AG019PK8
Molecular Formula:
C15H9ClF3N3O2S
Molecular Weight:
387.7641
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Product Description
Catalog Number:
AG019PK8
Chemical Name:
N-(3-chloroquinoxalin-2-yl)-2-(trifluoromethyl)benzene-1-sulfonamide
CAS Number:
877964-71-1
Molecular Formula:
C15H9ClF3N3O2S
Molecular Weight:
387.7641
MDL Number:
MFCD07850260
IUPAC Name:
N-(3-chloroquinoxalin-2-yl)-2-(trifluoromethyl)benzenesulfonamide
InChI:
InChI=1S/C15H9ClF3N3O2S/c16-13-14(21-11-7-3-2-6-10(11)20-13)22-25(23,24)12-8-4-1-5-9(12)15(17,18)19/h1-8H,(H,21,22)
InChI Key:
DBGXWMPLXLEJIZ-UHFFFAOYSA-N
SMILES:
Clc1nc2ccccc2nc1NS(=O)(=O)c1ccccc1C(F)(F)F
Properties
Complexity:
569  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
387.006g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
387.761g/mol
Monoisotopic Mass:
387.006g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
80.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Literature
Title Journal
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