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131185-37-0 | 1(6H)-Pyridazinebutanoic acid, 6-oxo-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-
CAS No: 131185-37-0 Catalog No: AG000VO0 MDL No:
Product Description
Catalog Number:
AG000VO0
Chemical Name:
1(6H)-Pyridazinebutanoic acid, 6-oxo-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-
CAS Number:
131185-37-0
Molecular Formula:
C21H18N4O3
Molecular Weight:
374.3926
IUPAC Name:
4-[6-oxo-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]butanoic acid
InChI:
InChI=1S/C21H18N4O3/c26-18-12-11-16(22-25(18)14-6-10-19(27)28)20-17-9-4-5-13-24(17)23-21(20)15-7-2-1-3-8-15/h1-5,7-9,11-13H,6,10,14H2,(H,27,28)
InChI Key:
FKJPZJACCBMNKZ-UHFFFAOYSA-N
SMILES:
OC(=O)CCCn1nc(ccc1=O)c1c(nn2c1cccc2)c1ccccc1
Properties
Complexity:
656
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.138g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
374.4g/mol
Monoisotopic Mass:
374.138g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
87.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| 2-Amino-5-benzoyl-4-phenylthiazoles: Development of potent and selective adenosine A1 receptor antagonists. | Bioorganic & medicinal chemistry 20100315 |
| Anti-inflammatory activity of non-nucleoside adenosine deaminase inhibitor FR234938. | European journal of pharmacology 20060318 |
| Role of macula densa adenosine triphosphate (ATP) in tubuloglomerular feedback. | Kidney international 20041001 |
| Effects of the adenosine A1 receptor inhibitor FK 838 on proximal tubular fluid output in rats. | Nephrology, dialysis, transplantation : official publication of the European Dialysis and Transplant Association - European Renal Association 20040501 |
| An orally active adenosine A1 receptor antagonist, FK838, increases renal excretion and maintains glomerular filtration rate in furosemide-resistant rats. | British journal of pharmacology 20030802 |
| Synthesis, molecular modeling studies, and pharmacological activity of selective A(1) receptor antagonists. | Journal of medicinal chemistry 20021024 |
| Possible role of adenosine in macula densa control of glomerular hemodynamics. | Kidney international 20020101 |
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