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Home Amines 1236199-60-2
1236199-60-2,MFCD29037367
Catalog No.:AA000KSE

1236199-60-2 | 1H-Benzimidazole-2-heptanamide, 5-[bis(2-chloroethyl)amino]-N-hydroxy-1-methyl-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98%
in stock  
$99.00   $69.00
- +
5mg
98%
in stock  
$232.00   $163.00
- +
10mg
98%
in stock  
$325.00   $227.00
- +
25mg
98%
in stock  
$423.00   $296.00
- +
50mg
98%
in stock  
$550.00   $385.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000KSE
Chemical Name:
1H-Benzimidazole-2-heptanamide, 5-[bis(2-chloroethyl)amino]-N-hydroxy-1-methyl-
CAS Number:
1236199-60-2
Molecular Formula:
C19H28Cl2N4O2
Molecular Weight:
415.3572
MDL Number:
MFCD29037367
SMILES:
ClCCN(c1ccc2c(c1)nc(n2C)CCCCCCC(=O)NO)CCCl
Properties
Computed Properties
 
Complexity:
438  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
12  
XLogP3:
3.6  

Downstream Synthesis Route
C19H27Cl2N3O2 
  1236199-60-2 

[1]Patent:WO2010/85377,2010,A2.Locationinpatent:Page/Pagecolumn42

[1]Patent:CN102993102,2016,B

1-methyl-2-(7'-heptanoate)-5-Ν,Ν-bis(2'-chloroethyl)-1H-benzimidazole 
  1236199-60-2 

[1]Patent:CN102993102,2016,B.Locationinpatent:Paragraph0079-0080

8-(2,4-dinitrophenyl)amino-8-oxoctanoicacidmethylester 
  1236199-60-2 

[1]Patent:CN102993102,2016,B

[1]Patent:CN102993102,2016,B

Literature

Title: Mehrling T, et al. The Alkylating-HDAC Inhibition Fusion Principle: Taking Chemotherapy to the Next Level with the First in Class Molecule EDO-S101. Anticancer Agents Med Chem. 2016;16(1):20-8.

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SDS
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Tags:1236199-60-2 Molecular Formula|1236199-60-2 MDL|1236199-60-2 SMILES|1236199-60-2 1H-Benzimidazole-2-heptanamide, 5-[bis(2-chloroethyl)amino]-N-hydroxy-1-methyl-