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Home > Indoles and Oxindole > 611-09-6
611-09-6 | 5-Nitroindoline-2,3-dione
CAS No: 611-09-6 Catalog No: AG0034B0 MDL No:MFCD00005720
Product Description
Catalog Number:
AG0034B0
Chemical Name:
5-Nitroindoline-2,3-dione
CAS Number:
611-09-6
Molecular Formula:
C8H4N2O4
Molecular Weight:
192.1284
MDL Number:
MFCD00005720
IUPAC Name:
5-nitro-1H-indole-2,3-dione
InChI:
InChI=1S/C8H4N2O4/c11-7-5-3-4(10(13)14)1-2-6(5)9-8(7)12/h1-3H,(H,9,11,12)
InChI Key:
UNMYHYODJHKLOC-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1=O)cc(cc2)[N+](=O)[O-]
EC Number:
210-252-5
UNII:
J4J633881Z
NSC Number:
525798
Properties
Complexity:
309
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.017g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.13g/mol
Monoisotopic Mass:
192.017g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
92A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Literature
| Title | Journal |
|---|---|
| Fully-branched hyperbranched polymers with a diselenide core as glutathione peroxidase mimics. | Macromolecular rapid communications 20120514 |
| (Z)-N-Methyl-2-(5-nitro-2-oxoindolin-3-yl-idene)hydrazinecarbothio-amide. | Acta crystallographica. Section E, Structure reports online 20120401 |
| (Z)-4-(3-Fluoro-phen-yl)-1-(5-nitro-2-oxo-indolin-3-yl-idene)thio-semicarbazide. | Acta crystallographica. Section E, Structure reports online 20120301 |
| 1-(5-Nitro-2-oxoindolin-3-yl-idene)thio-semicarbazide. | Acta crystallographica. Section E, Structure reports online 20111101 |
| Chemical synthesis, in vitro acetohydroxyacid synthase (AHAS) inhibition, herbicidal activity, and computational studies of isatin derivatives. | Journal of agricultural and food chemistry 20110928 |
| Isatin 1,2,3-triazoles as potent inhibitors against caspase-3. | Bioorganic & medicinal chemistry letters 20110315 |
| QSAR study of isatin analogues as in vitro anti-cancer agents. | European journal of medicinal chemistry 20100301 |
| (Z)-4-Hexyl-1-(5-nitro-2-oxo-2,3-dihydro-1H-indol-3-yl-idene)thio-semicarbazide. | Acta crystallographica. Section E, Structure reports online 20091101 |
| 1-(5-Nitro-2-oxoindolin-3-yl-idene)-4-o-tolyl-thio-semicarbazide methanol monosolvate. | Acta crystallographica. Section E, Structure reports online 20091101 |
| 1',5-Dinitro-2'-phenyl-2',3',5',6',7',7a'-hexa-hydro-spiro-[indoline-3,3'-1'H-pyrrolizin]-2-one. | Acta crystallographica. Section E, Structure reports online 20080901 |
| 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 |
| In vitro cytotoxicity evaluation of some substituted isatin derivatives. | Bioorganic & medicinal chemistry 20070115 |
| Explorations on the total synthesis of the unusual marine alkaloid chartelline A. | The Journal of organic chemistry 20060414 |
| A three-dimensional in silico pharmacophore model for inhibition of Plasmodium falciparum cyclin-dependent kinases and discovery of different classes of novel Pfmrk specific inhibitors. | Journal of medicinal chemistry 20041021 |
| Synthesis and evaluation of isatins and thiosemicarbazone derivatives against cruzain, falcipain-2 and rhodesain. | Bioorganic & medicinal chemistry letters 20031020 |
| Synthesis and primary cytotoxicity evaluation of new 5-nitroindole-2,3-dione derivatives. | European journal of medicinal chemistry 20021101 |
| An efficient conversion of 5-nitroisatin into 5-nitroindole derivative. | Bioorganic & medicinal chemistry letters 20010326 |
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