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1350462-55-3,MFCD31561045
Catalog No.:AA009CAK

1350462-55-3 | MK-5172 hydrate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5mg
99%
1 week  
$222.00   $155.00
- +
10mg
99%
1 week  
$317.00   $222.00
- +
50mg
99%
1 week  
$908.00   $635.00
- +
100mg
99%
1 week  
$1,289.00   $902.00
- +
  • Technical Information
  • Properties
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA009CAK
Chemical Name:
MK-5172 hydrate
CAS Number:
1350462-55-3
Molecular Formula:
C38H52N6O10S
Molecular Weight:
784.9187
MDL Number:
MFCD31561045
SMILES:
C=CC1CC1(NC(=O)C1CC2CN1C(=O)C(NC(=O)OC1CC1CCCCCc1c(O2)nc2cc(OC)ccc2n1)C(C)(C)C)C(=O)NS(=O)(=O)C1CC1.O
Properties
Computed Properties
 
Complexity:
1580  
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
7  
Heavy Atom Count:
55  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
4  
Rotatable Bond Count:
8  

Literature

Title: MK-5172 : a second-generation protease inhibitor for the treatment of hepatitis C virus infection.

Journal: Expert opinion on investigational drugs 20140501

Title: MK-5172, a selective inhibitor of hepatitis C virus NS3/4a protease with broad activity across genotypes and resistant variants.

Journal: Antimicrobial agents and chemotherapy 20120801

Title: Steven Harper , John A. McCauley , Michael T. Discovery of MK-5172, a Macrocyclic Hepatitis C Virus NS3/4a Protease Inhibitor. ACS Med. Chem. Lett., 2012, 3 (4), pp 332-336

Title: Summa V, Ludmerer SW, McCauley JA, MK-5172, a selective inhibitor of hepatitis C virus NS3/4a protease with broad activity across genotypes and resistant variants. Antimicrob Agents Chemother. 2012 Aug;56(8):4161-7.

Title: Qi Sun, et al. Bardoxolone and bardoxolone methyl, two Nrf2 activators in clinical trials, inhibit SARS-CoV-2 replication and its 3C-like protease. Signal Transduct Target Ther. 2021 May 29;6(1):212.

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SDS
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