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19116-90-6

19116-90-6 | Benzenesulfonamide, 2,5-dimethoxy-

CAS No: 19116-90-6 Catalog No: AG002F2P MDL No:MFCD00833415

Product Description

Catalog Number:
AG002F2P
Chemical Name:
Benzenesulfonamide, 2,5-dimethoxy-
CAS Number:
19116-90-6
Molecular Formula:
C8H11NO4S
Molecular Weight:
217.2422
MDL Number:
MFCD00833415
IUPAC Name:
2,5-dimethoxybenzenesulfonamide
InChI:
InChI=1S/C8H11NO4S/c1-12-6-3-4-7(13-2)8(5-6)14(9,10)11/h3-5H,1-2H3,(H2,9,10,11)
InChI Key:
MMHMYFWOECSGDR-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)S(=O)(=O)N)OC

Properties

Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.041g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
217.239g/mol
Monoisotopic Mass:
217.041g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  

Literature

Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
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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