Tìm theo
KW-3902
Thuốc Gốc
Small Molecule
CTHH: C20H28N4O2
PTK: 356.4619
KW-3902 is a compounds that is under clinical development by pharmaceutical company, NovaCardia. It is used for the treatment of congestive heart failure.
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C20H28N4O2
Phân tử khối
356.4619
Monoisotopic mass
356.22122616
InChI
InChI=1S/C20H28N4O2/c1-3-5-23-16-15(17(25)24(6-4-2)19(23)26)21-18(22-16)20-10-12-7-13(11-20)9-14(20)8-12/h12-14H,3-11H2,1-2H3,(H,21,22)
InChI Key
InChIKey=PJBFVWGQFLYWCB-UHFFFAOYSA-N
IUPAC Name
1,3-dipropyl-8-{tricyclo[3.3.1.0^{3,7}]nonan-3-yl}-2,3,6,7-tetrahydro-1H-purine-2,6-dione
Traditional IUPAC Name
rolofylline
SMILES
CCCN1C2=C(NC(=N2)C23CC4CC2CC(C3)C4)C(=O)N(CCC)C1=O
Độ hòa tan
1.25e-01 g/l
logP
3.27
logS
-3.5
pKa (strongest acidic)
7.83
pKa (Strongest Basic)
-0.72
PSA
69.3 Å2
Refractivity
99.06 m3·mol-1
Polarizability
40.67 Å3
Rotatable Bond Count
5
H Bond Acceptor Count
3
H Bond Donor Count
1
Physiological Charge
0
Number of Rings
5
Bioavailability
1
Rule of Five
true
Ghose Filter
true
Cơ Chế Tác Dụng : KW-3902 is a compounds that is under clinical development by pharmaceutical company, NovaCardia. It is used for the treatment of congestive heart failure. KW-3902 (rolofylline),is an adenosine A1-receptor antagonist, on diuresis and renal function compared with placebo in patients with acute decompensated heart failure (ADHF). Plasma adenosine levels are elevated in patients with heart failure and adenosine A1 receptors in the kidney mediate vasoconstriction of afferent arterioles, reabsorption of sodium and water in proximal tubules, and tubuloglomerular feedback in the juxtaglomerular apparatus. Accordingly, inhibition of these receptors would be expected to increase renal blood flow and enhance diuresis. The effects of KW-3902 on renal function are consistent with those obtained with another adenosine A1-receptor antagonist in both experimental and human heart failure.
Chỉ Định : Investigated for use/treatment in congestive heart failure and kidney disease.
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB05360
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=64627
ChemSpider
http://www.chemspider.com/Chemical-Structure.58188.html
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