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852389-11-8

852389-11-8 | N,N-diethyl-6-sulfanylpyridine-3-sulfonamide

CAS No: 852389-11-8 Catalog No: AG019O4S MDL No:MFCD06655477

Product Description

Catalog Number:
AG019O4S
Chemical Name:
N,N-diethyl-6-sulfanylpyridine-3-sulfonamide
CAS Number:
852389-11-8
Molecular Formula:
C9H14N2O2S2
Molecular Weight:
246.3497
MDL Number:
MFCD06655477
IUPAC Name:
N,N-diethyl-6-sulfanylidene-1H-pyridine-3-sulfonamide
InChI:
InChI=1S/C9H14N2O2S2/c1-3-11(4-2)15(12,13)8-5-6-9(14)10-7-8/h5-7H,3-4H2,1-2H3,(H,10,14)
InChI Key:
TZFBNECUDBBASL-UHFFFAOYSA-N
SMILES:
CCN(S(=O)(=O)c1ccc(nc1)S)CC

Properties

Complexity:
400  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.05g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
246.343g/mol
Monoisotopic Mass:
246.05g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
89.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  

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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