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1314118-94-9,MFCD29472226
Catalog No.:AA009CGD

1314118-94-9 | Mk2-in-1 (hydrochloride)

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98%
in stock  
$33.00   $23.00
- +
5mg
98%
in stock  
$62.00   $43.00
- +
10mg
98%
in stock  
$119.00   $83.00
- +
25mg
98%
in stock  
$266.00   $186.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA009CGD
Chemical Name:
Mk2-in-1 (hydrochloride)
CAS Number:
1314118-94-9
Molecular Formula:
C27H26Cl2N4O2
Molecular Weight:
509.4269
MDL Number:
MFCD29472226
SMILES:
Clc1ccc(cc1)c1ccc(o1)C(=O)N(c1ccc(cc1)N1CCNCC1)Cc1ccccn1.Cl
Properties
Computed Properties
 
Complexity:
645  
Covalently-Bonded Unit Count:
2  
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
6  

Literature

Title: Rao AU, et al. Facile synthesis of tetracyclic azepine and oxazocine derivatives and their potential as MAPKAP-K2 (MK2) inhibitors. Bioorg Med Chem Lett. 2012 Jan 15;22(2):1068-72.

Title: Huang X, et al. A three-step protocol for lead optimization: quick identification of key conformational features and functional groups in the SAR studies of non-ATP competitive MK2 (MAPKAPK2) inhibitors. Bioorg Med Chem Lett. 2012 Jan 1;22(1):65-70.

Title: Huang X, et al. Discovery and Hit-to-Lead Optimization of Non-ATP Competitive MK2 (MAPKAPK2) Inhibitors. ACS Med Chem Lett. 2011 Jun 24;2(8):632-7.

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SDS
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Tags:1314118-94-9 Molecular Formula|1314118-94-9 MDL|1314118-94-9 SMILES|1314118-94-9 Mk2-in-1 (hydrochloride)