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36892-43-0

36892-43-0 | 6-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-9-(2-methylpropyl)purin-2-a mine

CAS No: 36892-43-0 Catalog No: AG00D2V6 MDL No:

Product Description

Catalog Number:
AG00D2V6
Chemical Name:
6-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-9-(2-methylpropyl)purin-2-a mine
CAS Number:
36892-43-0
IUPAC Name:
6-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-9-(2-methylpropyl)purin-2-amine
InChI:
InChI=1S/C13H16N8O2S/c1-7(2)4-20-6-15-8-9(20)17-13(14)18-11(8)24-12-10(21(22)23)16-5-19(12)3/h5-7H,4H2,1-3H3,(H2,14,17,18)
InChI Key:
SEIMKLNUEAPZHV-UHFFFAOYSA-N
NSC Number:
44585

Properties

Complexity:
464  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.112g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
348.385g/mol
Monoisotopic Mass:
348.112g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
159A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

Literature

Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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