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26198-23-2

26198-23-2 | 1H-Benzotriazole-6-sulfonamide, N,N-diethyl-1-hydroxy-

CAS No: 26198-23-2 Catalog No: AG002S8C MDL No:MFCD03986046

Product Description

Catalog Number:
AG002S8C
Chemical Name:
1H-Benzotriazole-6-sulfonamide, N,N-diethyl-1-hydroxy-
CAS Number:
26198-23-2
Molecular Formula:
C10H14N4O3S
Molecular Weight:
270.3082
MDL Number:
MFCD03986046
IUPAC Name:
N,N-diethyl-3-hydroxybenzotriazole-5-sulfonamide
InChI:
InChI=1S/C10H14N4O3S/c1-3-13(4-2)18(16,17)8-5-6-9-10(7-8)14(15)12-11-9/h5-7,15H,3-4H2,1-2H3
InChI Key:
NCQKZZDOZJRYFM-UHFFFAOYSA-N
SMILES:
CCN(S(=O)(=O)c1ccc2c(c1)n(O)nn2)CC

Properties

Complexity:
379  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.079g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
270.307g/mol
Monoisotopic Mass:
270.079g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
96.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

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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