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141060-78-8

141060-78-8 | 6-(benzenesulfonyl)-2,3-dihydropyridazin-3-one

CAS No: 141060-78-8 Catalog No: AG01AGS4 MDL No:MFCD14729721

Product Description

Catalog Number:
AG01AGS4
Chemical Name:
6-(benzenesulfonyl)-2,3-dihydropyridazin-3-one
CAS Number:
141060-78-8
Molecular Formula:
C10H8N2O3S
Molecular Weight:
236.2471
MDL Number:
MFCD14729721
IUPAC Name:
3-(benzenesulfonyl)-1H-pyridazin-6-one
InChI:
InChI=1S/C10H8N2O3S/c13-9-6-7-10(12-11-9)16(14,15)8-4-2-1-3-5-8/h1-7H,(H,11,13)
InChI Key:
ZICCKDUVBPQRQT-UHFFFAOYSA-N
SMILES:
O=c1ccc(n[nH]1)S(=O)(=O)c1ccccc1

Properties

Complexity:
439  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.026g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
236.245g/mol
Monoisotopic Mass:
236.026g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
84A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  

Literature

Title Journal
A novel series of non-carboxylic acid, non-hydantoin inhibitors of aldose reductase with potent oral activity in diabetic rat models: 6-(5-chloro-3-methylbenzofuran-2-sulfonyl)-2H-pyridazin-3-one and congeners. Journal of medicinal chemistry 20051006
A highly selective, non-hydantoin, non-carboxylic acid inhibitor of aldose reductase with potent oral activity in diabetic rat models: 6-(5-chloro-3-methylbenzofuran- 2-sulfonyl)-2-H-pyridazin-3-one. Journal of medicinal chemistry 20030605

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