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Home > Indoles and Oxindole > 454180-94-0
454180-94-0 | 1H-Indole, 3,3'-(1-methyl-1H-pyrrole-2,5-diyl)bis[5-methyl-
CAS No: 454180-94-0 Catalog No: AG006ZNT MDL No:
Product Description
Catalog Number:
AG006ZNT
Chemical Name:
1H-Indole, 3,3'-(1-methyl-1H-pyrrole-2,5-diyl)bis[5-methyl-
CAS Number:
454180-94-0
Molecular Formula:
C23H21N3
Molecular Weight:
339.4329
IUPAC Name:
5-methyl-3-[1-methyl-5-(5-methyl-1H-indol-3-yl)pyrrol-2-yl]-1H-indole
InChI:
InChI=1S/C23H21N3/c1-14-4-6-20-16(10-14)18(12-24-20)22-8-9-23(26(22)3)19-13-25-21-7-5-15(2)11-17(19)21/h4-13,24-25H,1-3H3
InChI Key:
BNPUQQSAIRXVDY-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)c(c[nH]2)c1ccc(n1C)c1c[nH]c2c1cc(C)cc2
Properties
Complexity:
464
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.174g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
339.442g/mol
Monoisotopic Mass:
339.174g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
36.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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