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835884-84-9 | 1H-Imidazole, 2,2'-(1-methyl-1H-pyrrole-2,5-diyl)bis[4,5-diphenyl-
CAS No: 835884-84-9 Catalog No: AG0057EW MDL No:
Product Description
Catalog Number:
AG0057EW
Chemical Name:
1H-Imidazole, 2,2'-(1-methyl-1H-pyrrole-2,5-diyl)bis[4,5-diphenyl-
CAS Number:
835884-84-9
Molecular Formula:
C35H27N5
Molecular Weight:
517.6224
IUPAC Name:
2-[5-(4,5-diphenyl-1H-imidazol-2-yl)-1-methylpyrrol-2-yl]-4,5-diphenyl-1H-imidazole
InChI:
InChI=1S/C35H27N5/c1-40-28(34-36-30(24-14-6-2-7-15-24)31(37-34)25-16-8-3-9-17-25)22-23-29(40)35-38-32(26-18-10-4-11-19-26)33(39-35)27-20-12-5-13-21-27/h2-23H,1H3,(H,36,37)(H,38,39)
InChI Key:
VWEGZOGZTHXKIU-UHFFFAOYSA-N
SMILES:
Cn1c(ccc1c1nc(c([nH]1)c1ccccc1)c1ccccc1)c1nc(c([nH]1)c1ccccc1)c1ccccc1
Properties
Complexity:
717
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
517.227g/mol
Formal Charge:
0
Heavy Atom Count:
40
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
517.636g/mol
Monoisotopic Mass:
517.227g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
62.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7
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