4-Bromo-5,6-dimethoxyisoindolin-1-one - CAS 1042722-42-8

Catalog:	BB001369
Product Name:	4-Bromo-5,6-dimethoxyisoindolin-1-one
CAS:	1042722-42-8
Synonyms:	4-bromo-5,6-dimethoxy-2,3-dihydroisoindol-1-one; 4-bromo-5,6-dimethoxy-2,3-dihydroisoindol-1-one

Technical Data

Patents

Computed Properties

IUPAC Name:	4-bromo-5,6-dimethoxy-2,3-dihydroisoindol-1-one
Description:	4-Bromo-5,6-dimethoxyisoindolin-1-one (CAS# 1042722-42-8 ) is a useful research chemical.
Molecular Weight:	272.10
Molecular Formula:	C10H10BrNO3
Canonical SMILES:	COC1=C(C(=C2CNC(=O)C2=C1)Br)OC
InChI:	InChI=1S/C10H10BrNO3/c1-14-7-3-5-6(4-12-10(5)13)8(11)9(7)15-2/h3H,4H2,1-2H3,(H,12,13)
InChI Key:	KEDCFOZIJJIKRG-UHFFFAOYSA-N
LogP:	2.03850

Publication Number	Title	Priority Date
EP-2429987-A2	Amide compound, preparation method thereof and pharmaceutical composition comprising same	20090515
WO-2010131922-A2	Amide compound, preparation method thereof and pharmaceutical composition comprising same	20090515
KR-101124350-B1	Phenanthrene lactam derivative having anticancer activity, preparation method thereof and pharmaceutical composition comprising the same	20071017
KR-20090039038-A	Phenanthrene lactam derivative having anticancer activity, preparation method thereof and pharmaceutical composition comprising the same	20071017
WO-2009051417-A2	Phenanthrene lactam derivatives having anticancer activity and method for the preparation thereof	20071017

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[957292-12-5]
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid

Complexity:	261
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	270.98441
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	270.98441
Rotatable Bond Count:	2
Topological Polar Surface Area:	47.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4