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36268-67-4

36268-67-4 | N-(4-Cyanophenyl);methanesulfonamide

CAS No: 36268-67-4 Catalog No: AG003K8T MDL No:MFCD00204724

Product Description

Catalog Number:
AG003K8T
Chemical Name:
N-(4-Cyanophenyl);methanesulfonamide
CAS Number:
36268-67-4
Molecular Formula:
C8H8N2O2S
Molecular Weight:
196.2263
MDL Number:
MFCD00204724
IUPAC Name:
N-(4-cyanophenyl)methanesulfonamide
InChI:
InChI=1S/C8H8N2O2S/c1-13(11,12)10-8-4-2-7(6-9)3-5-8/h2-5,10H,1H3
InChI Key:
BRDHOCVMWSXEHI-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)NS(=O)(=O)C

Properties

Complexity:
301  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.031g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
196.224g/mol
Monoisotopic Mass:
196.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  

Literature

Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Establishment of an enzyme-linked immunosorbent assay for measurement of sotalol. Biological & pharmaceutical bulletin 20040101

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