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83657-48-1 | Imidazo[1,2-b][1,2,4]triazine, 6-(4-methylphenyl)-2-phenyl-
CAS No: 83657-48-1 Catalog No: AG004Y2F MDL No:
Product Description
Catalog Number:
AG004Y2F
Chemical Name:
Imidazo[1,2-b][1,2,4]triazine, 6-(4-methylphenyl)-2-phenyl-
CAS Number:
83657-48-1
Molecular Formula:
C18H14N4
Molecular Weight:
286.3306
IUPAC Name:
6-(4-methylphenyl)-2-phenylimidazo[1,2-b][1,2,4]triazine
InChI:
InChI=1S/C18H14N4/c1-13-7-9-15(10-8-13)17-12-22-18(20-17)19-11-16(21-22)14-5-3-2-4-6-14/h2-12H,1H3
InChI Key:
DLJZAJAESRGUNM-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)c1cn2c(n1)ncc(n2)c1ccccc1
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.122g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.338g/mol
Monoisotopic Mass:
286.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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