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71270-63-8

71270-63-8 | Methanesulfonamide, N-[2,6-bis(1-methylethyl)phenyl]-

CAS No: 71270-63-8 Catalog No: AG0069IZ MDL No:

Product Description

Catalog Number:
AG0069IZ
Chemical Name:
Methanesulfonamide, N-[2,6-bis(1-methylethyl)phenyl]-
CAS Number:
71270-63-8
Molecular Formula:
C13H21NO2S
Molecular Weight:
255.3763
IUPAC Name:
N-[2,6-di(propan-2-yl)phenyl]methanesulfonamide
InChI:
InChI=1S/C13H21NO2S/c1-9(2)11-7-6-8-12(10(3)4)13(11)14-17(5,15)16/h6-10,14H,1-5H3
InChI Key:
AVIZANWBOIEVFT-UHFFFAOYSA-N
SMILES:
CC(c1cccc(c1NS(=O)(=O)C)C(C)C)C

Properties

Complexity:
314  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.129g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
255.376g/mol
Monoisotopic Mass:
255.129g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

Literature

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

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