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Home > Indoles and Oxindole > 86222-12-0
86222-12-0 | 1(7H)-Indolizinone, 7-(4-oxo-2,5-cyclohexadien-1-ylidene)-2,3-diphenyl-
CAS No: 86222-12-0 Catalog No: AG004JTS MDL No:
Product Description
Catalog Number:
AG004JTS
Chemical Name:
1(7H)-Indolizinone, 7-(4-oxo-2,5-cyclohexadien-1-ylidene)-2,3-diphenyl-
CAS Number:
86222-12-0
Molecular Formula:
C26H17NO2
Molecular Weight:
375.4187
IUPAC Name:
7-(4-oxocyclohexa-2,5-dien-1-ylidene)-2,3-diphenylindolizin-1-one
InChI:
InChI=1S/C26H17NO2/c28-22-13-11-18(12-14-22)21-15-16-27-23(17-21)26(29)24(19-7-3-1-4-8-19)25(27)20-9-5-2-6-10-20/h1-17H
InChI Key:
FJEQQTPZWBTKDS-UHFFFAOYSA-N
SMILES:
O=C1C=CC(=c2ccn3c(c2)C(=O)C(=C3c2ccccc2)c2ccccc2)C=C1
Properties
Complexity:
894
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
375.126g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
375.427g/mol
Monoisotopic Mass:
375.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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