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337922-56-2

337922-56-2 | N-(2,6-dimethylphenyl)-2-[N-(pyridin-2-yl)benzenesulfonamido]acetamide

CAS No: 337922-56-2 Catalog No: AG00IN0S MDL No:MFCD00793160

Product Description

Catalog Number:
AG00IN0S
Chemical Name:
N-(2,6-dimethylphenyl)-2-[N-(pyridin-2-yl)benzenesulfonamido]acetamide
CAS Number:
337922-56-2
Molecular Formula:
C21H21N3O3S
Molecular Weight:
395.4747
MDL Number:
MFCD00793160
IUPAC Name:
2-[benzenesulfonyl(pyridin-2-yl)amino]-N-(2,6-dimethylphenyl)acetamide
InChI:
InChI=1S/C21H21N3O3S/c1-16-9-8-10-17(2)21(16)23-20(25)15-24(19-13-6-7-14-22-19)28(26,27)18-11-4-3-5-12-18/h3-14H,15H2,1-2H3,(H,23,25)
InChI Key:
ANWCKTJDBIAFMW-UHFFFAOYSA-N
SMILES:
O=C(CN(S(=O)(=O)c1ccccc1)c1ccccn1)Nc1c(C)cccc1C

Properties

Complexity:
603  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
395.13g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
395.477g/mol
Monoisotopic Mass:
395.13g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
87.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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

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