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210049-13-1

210049-13-1 | 1H-Imidazo[4,5-b]pyridin-2-amine, 1-(methyl-d3)-6-phenyl-

CAS No: 210049-13-1 Catalog No: AG002KJL MDL No:

Product Description

Catalog Number:
AG002KJL
Chemical Name:
1H-Imidazo[4,5-b]pyridin-2-amine, 1-(methyl-d3)-6-phenyl-
CAS Number:
210049-13-1
Molecular Formula:
C13H9D3N4
Molecular Weight:
227.2797
IUPAC Name:
6-phenyl-1-(trideuteriomethyl)imidazo[4,5-b]pyridin-2-amine
InChI:
InChI=1S/C13H12N4/c1-17-11-7-10(9-5-3-2-4-6-9)8-15-12(11)16-13(17)14/h2-8H,1H3,(H2,14,15,16)/i1D3
InChI Key:
UQVKZNNCIHJZLS-FIBGUPNXSA-N
SMILES:
Nc1nc2c(n1C([2H])([2H])[2H])cc(cn2)c1ccccc1

Properties

Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.125g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
3  
Molecular Weight:
227.285g/mol
Monoisotopic Mass:
227.125g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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