Home Amines 956154-63-5
956154-63-5,MFCD26792580
Catalog No.:AA01ENKT

956154-63-5 | 2-Methylpropanethioicacid-S-[(6S)-6-[[(1,1-dimethylethoxy)carbonyl]amino]-7-oxo-7-(tricyclo[3.3.1.13,7]dec-1-ylamino)heptyl]ester

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Purity
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1mg
≥95%
in stock  
$46.00   $32.00
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5mg
≥95%
in stock  
$208.00   $145.00
- +
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  • Technical Information
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Technical Information
Catalog Number:
AA01ENKT
Chemical Name:
2-Methylpropanethioicacid-S-[(6S)-6-[[(1,1-dimethylethoxy)carbonyl]amino]-7-oxo-7-(tricyclo[3.3.1.13,7]dec-1-ylamino)heptyl]ester
CAS Number:
956154-63-5
Molecular Formula:
C26H44N2O4S
Molecular Weight:
480.7036
MDL Number:
MFCD26792580
SMILES:
O=C(OC(C)(C)C)NC(C(=O)NC12CC3CC(C2)CC(C1)C3)CCCCCSC(=O)C(C)C
Properties
Computed Properties
 
Complexity:
674  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
13  
XLogP3:
5.9  

Literature

Title: Design, synthesis, structure--selectivity relationship, and effect on human cancer cells of a novel series of histone deacetylase 6-selective inhibitors.

Journal: Journal of medicinal chemistry 20071101

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Tags:956154-63-5 Molecular Formula|956154-63-5 MDL|956154-63-5 SMILES|956154-63-5 2-Methylpropanethioicacid-S-[(6S)-6-[[(1,1-dimethylethoxy)carbonyl]amino]-7-oxo-7-(tricyclo[3.3.1.13,7]dec-1-ylamino)heptyl]ester