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Home Other Building Blocks N-Acetyl-4-S-cysteaminylphenol

N-Acetyl-4-S-cysteaminylphenol

CAS No.:
91281-32-2
Catalog Number:
AG00394A
Molecular Formula:
C10H13NO2S
Molecular Weight:
211.2807
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Product Description
Catalog Number:
AG00394A
Chemical Name:
N-Acetyl-4-S-cysteaminylphenol
CAS Number:
91281-32-2
Molecular Formula:
C10H13NO2S
Molecular Weight:
211.2807
MDL Number:
MFCD07779474
IUPAC Name:
N-[2-(4-hydroxyphenyl)sulfanylethyl]acetamide
InChI:
InChI=1S/C10H13NO2S/c1-8(12)11-6-7-14-10-4-2-9(13)3-5-10/h2-5,13H,6-7H2,1H3,(H,11,12)
InChI Key:
FDPFDQAWKAWHMY-UHFFFAOYSA-N
SMILES:
CC(=O)NCCSc1ccc(cc1)O
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.067g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
211.279g/mol
Monoisotopic Mass:
211.067g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
Synthesis and antimelanoma activity of reversed amide analogues of N-acetyl-4-S-cysteaminylphenol. Oncology research 20060101
Synthesis and antimelanoma activity of sterically congested tertiary amide analogues of N-acetyl-4-S-cysteaminylphenol. Oncology research 20050101
Synthesis and antimelanoma activity of tertiary amide analogues of N-acetyl-4-S-cysteaminylphenol. Oncology research 20030101
Synthesis and anti-melanoma activity of analogues of N-acetyl-4-S-cysteaminylphenol substituted with two methyl groups alpha to the nitrogen. Anti-cancer drug design 20010201
Properties