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122457-31-2

122457-31-2 | 3H-Imidazo[4,5-f]quinoxalin-2-amine, 8-methyl-3-(methyl-d3)- (9CI)

CAS No: 122457-31-2 Catalog No: AG00179C MDL No:

Product Description

Catalog Number:
AG00179C
Chemical Name:
3H-Imidazo[4,5-f]quinoxalin-2-amine, 8-methyl-3-(methyl-d3)- (9CI)
CAS Number:
122457-31-2
Molecular Formula:
C11H8D3N5
Molecular Weight:
216.2570
IUPAC Name:
8-methyl-3-(trideuteriomethyl)imidazo[4,5-f]quinoxalin-2-amine
InChI:
InChI=1S/C11H11N5/c1-6-5-13-7-3-4-8-10(9(7)14-6)15-11(12)16(8)2/h3-5H,1-2H3,(H2,12,15)/i2D3
InChI Key:
DVCCCQNKIYNAKB-BMSJAHLVSA-N
SMILES:
Cc1cnc2c(n1)c1nc(n(c1cc2)C([2H])([2H])[2H])N

Properties

Complexity:
271  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.12g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
3  
Molecular Weight:
216.262g/mol
Monoisotopic Mass:
216.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

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