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Home Other Building Blocks 300815-04-7
300815-04-7,MFCD00525727
Catalog No.:AA00BJTQ

300815-04-7 | Apcin

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
≥98%
in stock  
$53.00   $37.00
- +
5mg
≥98%
in stock  
$182.00   $127.00
- +
10mg
≥98%
in stock  
$255.00   $178.00
- +
25mg
≥98%
in stock  
$568.00   $397.00
- +
500mg
98% by HPLC
in stock  
$10,317.00   $7,222.00
- +
1000mg
98% by HPLC
in stock  
$16,471.00   $11,530.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00BJTQ
Chemical Name:
Apcin
CAS Number:
300815-04-7
Molecular Formula:
C13H14Cl3N7O4
Molecular Weight:
438.6538
MDL Number:
MFCD00525727
SMILES:
O=C(NC(C(Cl)(Cl)Cl)Nc1ncccn1)OCCn1c(C)ncc1[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
513  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
7  
Undefined Atom Stereocenter Count:
1  
XLogP3:
3  

Downstream Synthesis Route
C13H12N4O7 
  300815-04-7 

[1]Huang,Pan;Le,Xiangyang;Huang,Fei;Yang,Jie;Yang,Haofeng;Ma,Junlong;Hu,Gaoyun;Li,Qianbin;Chen,Zhuo[JournalofMedicinalChemistry,2020,vol.63,#9,p.4685-4700]

[1]Huang,Pan;Le,Xiangyang;Huang,Fei;Yang,Jie;Yang,Haofeng;Ma,Junlong;Hu,Gaoyun;Li,Qianbin;Chen,Zhuo[JournalofMedicinalChemistry,2020,vol.63,#9,p.4685-4700]

176799-58-9   
C9H10Cl4N4O4 
  300815-04-7 

[1]Huang,Pan;Le,Xiangyang;Huang,Fei;Yang,Jie;Yang,Haofeng;Ma,Junlong;Hu,Gaoyun;Li,Qianbin;Chen,Zhuo[JournalofMedicinalChemistry,2020,vol.63,#9,p.4685-4700]

2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl(2,2,2-trichloro-1-hydroxyethyl)carbamate 
  300815-04-7 

[1]Huang,Pan;Le,Xiangyang;Huang,Fei;Yang,Jie;Yang,Haofeng;Ma,Junlong;Hu,Gaoyun;Li,Qianbin;Chen,Zhuo[JournalofMedicinalChemistry,2020,vol.63,#9,p.4685-4700]

[1]Huang,Pan;Le,Xiangyang;Huang,Fei;Yang,Jie;Yang,Haofeng;Ma,Junlong;Hu,Gaoyun;Li,Qianbin;Chen,Zhuo[JournalofMedicinalChemistry,2020,vol.63,#9,p.4685-4700]

Literature
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SDS
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