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Home > Indoles and Oxindole > 88207-55-0
88207-55-0 | 1H-Indole, 1,3-bis(phenylsulfonyl)-2-(2-pyridinyl)-
CAS No: 88207-55-0 Catalog No: AG004C3C MDL No:
Product Description
Catalog Number:
AG004C3C
Chemical Name:
1H-Indole, 1,3-bis(phenylsulfonyl)-2-(2-pyridinyl)-
CAS Number:
88207-55-0
Molecular Formula:
C25H18N2O4S2
Molecular Weight:
474.5514
IUPAC Name:
1,3-bis(benzenesulfonyl)-2-pyridin-2-ylindole
InChI:
InChI=1S/C25H18N2O4S2/c28-32(29,19-11-3-1-4-12-19)25-21-15-7-8-17-23(21)27(24(25)22-16-9-10-18-26-22)33(30,31)20-13-5-2-6-14-20/h1-18H
InChI Key:
OIXTTWNYHNIIHL-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1c2ccccc2n(c1c1ccccn1)S(=O)(=O)c1ccccc1)c1ccccc1
Properties
Complexity:
867
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
474.071g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
474.549g/mol
Monoisotopic Mass:
474.071g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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