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Home > Indoles and Oxindole > 866035-89-4
866035-89-4 | 5H-Pyrido[4,3-b]indole, 5,5'-[1,1'-biphenyl]-4,4'-diylbis[8-methyl-
CAS No: 866035-89-4 Catalog No: AG004PFX MDL No:
Product Description
Catalog Number:
AG004PFX
Chemical Name:
5H-Pyrido[4,3-b]indole, 5,5'-[1,1'-biphenyl]-4,4'-diylbis[8-methyl-
CAS Number:
866035-89-4
Molecular Formula:
C36H26N4
Molecular Weight:
514.6184
IUPAC Name:
8-methyl-5-[4-[4-(8-methylpyrido[4,3-b]indol-5-yl)phenyl]phenyl]pyrido[4,3-b]indole
InChI:
InChI=1S/C36H26N4/c1-23-3-13-33-29(19-23)31-21-37-17-15-35(31)39(33)27-9-5-25(6-10-27)26-7-11-28(12-8-26)40-34-14-4-24(2)20-30(34)32-22-38-18-16-36(32)40/h3-22H,1-2H3
InChI Key:
YEAMOSGYUOQLRA-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)c1cnccc1n2c1ccc(cc1)c1ccc(cc1)n1c2ccc(cc2c2c1ccnc2)C
Properties
Complexity:
791
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
514.216g/mol
Formal Charge:
0
Heavy Atom Count:
40
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
514.632g/mol
Monoisotopic Mass:
514.216g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.3
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