CAS 2058-74-4 | 1H-Indole-2,3-dione, 1-methyl- | CAS Number 2058-74-4

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2058-74-4 | 1H-Indole-2,3-dione, 1-methyl-

CAS No: 2058-74-4 Catalog No: AG002ADH MDL No:MFCD00005812

Product Description

Catalog Number:

AG002ADH

Chemical Name:

1H-Indole-2,3-dione, 1-methyl-

CAS Number:

2058-74-4

Molecular Formula:

C9H7NO2

Molecular Weight:

161.1574

MDL Number:

MFCD00005812

IUPAC Name:

1-methylindole-2,3-dione

InChI:

InChI=1S/C9H7NO2/c1-10-7-5-3-2-4-6(7)8(11)9(10)12/h2-5H,1H3

InChI Key:

VCYBVWFTGAZHGH-UHFFFAOYSA-N

SMILES:

O=C1c2ccccc2N(C1=O)C

EC Number:

218-164-9

NSC Number:

42449

Properties

Complexity:

237

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

161.048g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

161.16g/mol

Monoisotopic Mass:

161.048g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

37.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6

Literature

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1',1''-Dimethyl-4'-(naphthalen-1-yl)-1,2,3,4-tetra-hydro-naphthalene-2-spiro-3'-pyrrolidine-2'-spiro-3''-indoline-1,2''-dione.	Acta crystallographica. Section E, Structure reports online 20110401
1-(Morpholino-meth-yl)indoline-2,3-dione.	Acta crystallographica. Section E, Structure reports online 20100701
1-Tetra-decyl-indoline-2,3-dione.	Acta crystallographica. Section E, Structure reports online 20100601
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Historical perspectives in the development of antiviral agents against poxviruses.	Viruses 20100601
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Synthesis and characterization of new Schiff bases derived from N (1)-substituted isatin with dithiooxamide and their Co(II), Ni(II), Cu(II), Pd(II), and Pt(IV) complexes.	Bioinorganic chemistry and applications 20090101
Polar [3 + 2] cycloaddition of ketones with electrophilically activated carbonyl ylides. Synthesis of spirocyclic dioxolane indolinones.	Organic & biomolecular chemistry 20080907
N-methylisatin-beta-thiosemicarbazone derivative (SCH 16) is an inhibitor of Japanese encephalitis virus infection in vitro and in vivo.	Virology journal 20080101
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Straightforward stereoselective synthesis of spiro-epoxyoxindoles.	Organic letters 20070426
Selective inhibition of carboxylesterases by isatins, indole-2,3-diones.	Journal of medicinal chemistry 20070419
In vitro cytotoxicity evaluation of some substituted isatin derivatives.	Bioorganic & medicinal chemistry 20070115
Complexes of 2-thiophenecarbonyl and isonicotinoyl hydrazones of 3-(N-methyl)isatin. A study of their antimicrobial activity.	Journal of inorganic biochemistry 20070101
From actually toxic to highly specific--novel drugs against poxviruses.	Virology journal 20070101
Isatin 3-semicarbazone and 1-methylisatin 3-semicarbazone.	Acta crystallographica. Section C, Crystal structure communications 20051001
Antimicrobial and mutagenic properties of organotin(IV) complexes with isatin and N-alkylisatin bisthiocarbonohydrazones.	Journal of inorganic biochemistry 20050201
Synthesis, characterization and biological activity of Ni, Cu and Zn complexes of isatin hydrazones.	Journal of inorganic biochemistry 20040201
Synthesis and evaluation of isatins and thiosemicarbazone derivatives against cruzain, falcipain-2 and rhodesain.	Bioorganic & medicinal chemistry letters 20031020
Are isatin and isatoic anhydride antiaromatic and aromatic respectively? A combined experimental and theoretical investigation.	Organic & biomolecular chemistry 20030721
Potent and selective nonpeptide inhibitors of caspases 3 and 7.	Journal of medicinal chemistry 20010607
Design, synthesis, and evaluation of nonpeptidic inhibitors of human rhinovirus 3C protease.	Journal of medicinal chemistry 19961220
Inactivation of herpes simplex virus by thiosemicarbazones and certain cations.	Antimicrobial agents and chemotherapy 19740401