3-(4-Methoxybenzylidene)-2-indolinone - CAS 55160-02-6

Catalog:	BB028926
Product Name:	3-(4-Methoxybenzylidene)-2-indolinone
CAS:	55160-02-6
Synonyms:	3-[(4-methoxyphenyl)methylidene]-1H-indol-2-one; 3-[(4-methoxyphenyl)methylidene]-1H-indol-2-one

Technical Data

Patents

Computed Properties

IUPAC Name:	3-[(4-methoxyphenyl)methylidene]-1H-indol-2-one
Description:	3-(4-Methoxybenzylidene)-2-indolinone (CAS# 55160-02-6 ) is a useful research chemical.
Molecular Weight:	251.28
Molecular Formula:	C16H13NO2
Canonical SMILES:	COC1=CC=C(C=C1)C=C2C3=CC=CC=C3NC2=O
InChI:	InChI=1S/C16H13NO2/c1-19-12-8-6-11(7-9-12)10-14-13-4-2-3-5-15(13)17-16(14)18/h2-10H,1H3,(H,17,18)
InChI Key:	SOHLANGNFXOOEF-UHFFFAOYSA-N
LogP:	3.32590

Publication Number	Title	Priority Date
US-2015045395-A1	Method of using an indolinone molecule and derivatives for inhibiting liver fibrosis and hepatitis	20130809
AU-2005297923-B2	Solid medicinal preparation improved in solubility and stability and process for producing the same	20041025
EP-1696906-A1	Novel therapeutic use of indolinone derivatives	20031216
US-2007167488-A1	Novel therapeutic use	20031216
WO-2005058309-A1	Novel therapeutic use of indolinone derivatives	20031216

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Complexity:	369
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	251.094628657
Formal Charge:	0
Heavy Atom Count:	19
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	251.094628657
Rotatable Bond Count:	2
Topological Polar Surface Area:	38.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	1
XLogP3:	2.9