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82495-70-3

82495-70-3 | (S)-()-N-[1-(Hydroxymethyl)-2-phenylethyl]-4-methylbenzenesulfonamide

CAS No: 82495-70-3 Catalog No: AG003CF9 MDL No:

Product Description

Catalog Number:
AG003CF9
Chemical Name:
(S)-()-N-[1-(Hydroxymethyl)-2-phenylethyl]-4-methylbenzenesulfonamide
CAS Number:
82495-70-3
IUPAC Name:
N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-4-methylbenzenesulfonamide
InChI:
InChI=1S/C16H19NO3S/c1-13-7-9-16(10-8-13)21(19,20)17-15(12-18)11-14-5-3-2-4-6-14/h2-10,15,17-18H,11-12H2,1H3/t15-/m0/s1
InChI Key:
QSUGRMCPSKTJTP-HNNXBMFYSA-N

Properties

Complexity:
390  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
305.109g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
305.392g/mol
Monoisotopic Mass:
305.109g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

Literature

Title Journal
Synthesis and biological evaluation of reversible inhibitors of IdeS, a bacterial cysteine protease and virulence determinant. Bioorganic & medicinal chemistry 20090501

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