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6890-08-0

6890-08-0 | 2-HYDROXYISOQUINOLINE-1,3(2H,4H)-DIONE

CAS No: 6890-08-0 Catalog No: AG00FDF9 MDL No:MFCD00835191

Product Description

Catalog Number:
AG00FDF9
Chemical Name:
2-HYDROXYISOQUINOLINE-1,3(2H,4H)-DIONE
CAS Number:
6890-08-0
MDL Number:
MFCD00835191
IUPAC Name:
2-hydroxy-4H-isoquinoline-1,3-dione
InChI:
InChI=1S/C9H7NO3/c11-8-5-6-3-1-2-4-7(6)9(12)10(8)13/h1-4,13H,5H2
InChI Key:
ZXAICCBFIBBVAR-UHFFFAOYSA-N

Properties

Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.043g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
177.159g/mol
Monoisotopic Mass:
177.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

Literature

Title Journal
2-Hydroxyisoquinoline-1,3(2H,4H)-diones (HIDs), novel inhibitors of HIV integrase with a high barrier to resistance. ACS chemical biology 20130101
Identification of influenza endonuclease inhibitors using a novel fluorescence polarization assay. ACS chemical biology 20120316
Magnesium chelating 2-hydroxyisoquinoline-1,3(2H,4H)-diones, as inhibitors of HIV-1 integrase and/or the HIV-1 reverse transcriptase ribonuclease H domain: discovery of a novel selective inhibitor of the ribonuclease H function. Journal of medicinal chemistry 20110324
2-hydroxyisoquinoline-1,3(2H,4H)-diones as inhibitors of HIV-1 integrase and reverse transcriptase RNase H domain: influence of the alkylation of position 4. European journal of medicinal chemistry 20110201
Potent and selective HIV-1 ribonuclease H inhibitors based on a 1-hydroxy-1,8-naphthyridin-2(1H)-one scaffold. Bioorganic & medicinal chemistry letters 20101115
Design, synthesis, and biological evaluation of a series of 2-hydroxyisoquinoline-1,3(2H,4H)-diones as dual inhibitors of human immunodeficiency virus type 1 integrase and the reverse transcriptase RNase H domain. Journal of medicinal chemistry 20081225
Substrate-dependent inhibition or stimulation of HIV RNase H activity by non-nucleoside reverse transcriptase inhibitors (NNRTIs). Biochemical and biophysical research communications 20070112
Activity of the isolated HIV RNase H domain and specific inhibition by N-hydroxyimides. Biochemical and biophysical research communications 20040430
Use of a pharmacophore model to discover a new class of influenza endonuclease inhibitors. Journal of medicinal chemistry 20030327

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