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17630-76-1 | 1H-Indole-2,3-dione, 5-chloro-
CAS No: 17630-76-1 Catalog No: AG0024L6 MDL No:MFCD00014567
Product Description
Catalog Number:
AG0024L6
Chemical Name:
1H-Indole-2,3-dione, 5-chloro-
CAS Number:
17630-76-1
Molecular Formula:
C8H4ClNO2
Molecular Weight:
181.5759
MDL Number:
MFCD00014567
IUPAC Name:
5-chloro-1H-indole-2,3-dione
InChI:
InChI=1S/C8H4ClNO2/c9-4-1-2-6-5(3-4)7(11)8(12)10-6/h1-3H,(H,10,11,12)
InChI Key:
XHDJYQWGFIBCEP-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)C(=O)C(=O)N2
EC Number:
241-614-0
NSC Number:
135811
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.993g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.575g/mol
Monoisotopic Mass:
180.993g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
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| (Z)-2-(5-Chloro-2-oxoindolin-3-yl-idene)-N-methyl-hydrazinecarbothio-amide. | Acta crystallographica. Section E, Structure reports online 20120401 |
| (Z)-2-(5-Chloro-2-oxoindolin-3-yl-idene)-N-phenyl-hydrazinecarbothio-amide. | Acta crystallographica. Section E, Structure reports online 20111201 |
| Chemical synthesis, in vitro acetohydroxyacid synthase (AHAS) inhibition, herbicidal activity, and computational studies of isatin derivatives. | Journal of agricultural and food chemistry 20110928 |
| 5-Chloro-1-(4-meth-oxy-benz-yl)indoline-2,3-dione. | Acta crystallographica. Section E, Structure reports online 20110201 |
| Small-molecule inhibitor leads of ribosome-inactivating proteins developed using the doorstop approach. | PloS one 20110101 |
| 5-Chloro-indoline-2,3-dione. | Acta crystallographica. Section E, Structure reports online 20101101 |
| Investigation of trypanothione reductase as a drug target in Trypanosoma brucei. | ChemMedChem 20091207 |
| N-(4-Chloro-phen-yl)-2-(hydroxy-imino)acetamide. | Acta crystallographica. Section E, Structure reports online 20090901 |
| Synthesis of Schiff and Mannich bases of isatin derivatives with 4-amino-4,5-dihydro-1H-1,2,4-triazole-5-ones. | Molecules (Basel, Switzerland) 20080910 |
| Polar [3 + 2] cycloaddition of ketones with electrophilically activated carbonyl ylides. Synthesis of spirocyclic dioxolane indolinones. | Organic & biomolecular chemistry 20080907 |
| Design, Synthesis and antiHIV activity of Novel Isatine-Sulphonamides. | Indian journal of pharmaceutical sciences 20080101 |
| Biological targets for isatin and its analogues: Implications for therapy. | Biologics : targets & therapy 20070601 |
| Selective inhibition of carboxylesterases by isatins, indole-2,3-diones. | Journal of medicinal chemistry 20070419 |
| Synthesis and evaluation of isatins and thiosemicarbazone derivatives against cruzain, falcipain-2 and rhodesain. | Bioorganic & medicinal chemistry letters 20031020 |
| Synthesis and antiviral evaluation of isatin ribonucleosides. | Nucleosides, nucleotides & nucleic acids 20020101 |
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