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47798-67-4 | 1,3-Diallyl-2-[2-(1-methoxy-2-phenyl-1H-indole-3-yl)ethenyl]-1H-imidazo[4,5-b]quinoxaline-3-ium
CAS No: 47798-67-4 Catalog No: AG00DSKP MDL No:
Product Description
Catalog Number:
AG00DSKP
Chemical Name:
1,3-Diallyl-2-[2-(1-methoxy-2-phenyl-1H-indole-3-yl)ethenyl]-1H-imidazo[4,5-b]quinoxaline-3-ium
CAS Number:
47798-67-4
IUPAC Name:
2-[2-(1-methoxy-2-phenylindol-3-yl)ethenyl]-1,3-bis(prop-2-enyl)imidazo[4,5-b]quinoxalin-3-ium
InChI:
InChI=1S/C32H28N5O/c1-4-21-35-29(36(22-5-2)32-31(35)33-26-16-10-11-17-27(26)34-32)20-19-25-24-15-9-12-18-28(24)37(38-3)30(25)23-13-7-6-8-14-23/h4-20H,1-2,21-22H2,3H3/q+1
InChI Key:
YUUJOADQCBPLJI-UHFFFAOYSA-N
Properties
Complexity:
808
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
498.229g/mol
Formal Charge:
1
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
498.61g/mol
Monoisotopic Mass:
498.229g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
48.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
7.5
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