Home Aminos 1,2-Benzenediol, 4-[(1R)-1-hydroxy-2-[[4-(4-hydroxyphenyl)butyl]amino]ethyl]-

1,2-Benzenediol, 4-[(1R)-1-hydroxy-2-[[4-(4-hydroxyphenyl)butyl]amino]ethyl]-

CAS No.:
128470-16-6
Catalog Number:
AG000Y4Z
Molecular Formula:
C18H23NO4
Molecular Weight:
317.3795
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Product Description
Catalog Number:
AG000Y4Z
Chemical Name:
1,2-Benzenediol, 4-[(1R)-1-hydroxy-2-[[4-(4-hydroxyphenyl)butyl]amino]ethyl]-
CAS Number:
128470-16-6
Molecular Formula:
C18H23NO4
Molecular Weight:
317.3795
MDL Number:
MFCD16628073
IUPAC Name:
4-[(1R)-1-hydroxy-2-[4-(4-hydroxyphenyl)butylamino]ethyl]benzene-1,2-diol
InChI:
InChI=1S/C18H23NO4/c20-15-7-4-13(5-8-15)3-1-2-10-19-12-18(23)14-6-9-16(21)17(22)11-14/h4-9,11,18-23H,1-3,10,12H2/t18-/m0/s1
InChI Key:
IIRWWTKISYTTBL-SFHVURJKSA-N
SMILES:
Oc1ccc(cc1)CCCCNC[C@@H](c1ccc(c(c1)O)O)O
UNII:
B07L15YAEV
Properties
Complexity:
320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
317.163g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
317.385g/mol
Monoisotopic Mass:
317.163g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
93A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Literature
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Assessment of adenosine, arbutamine and dobutamine as pharmacological stress agents during (99m)Tc-tetrofosmin SPECT imaging: a randomized study. Nuclear medicine communications 20011201
Pharmacological stress agents for evaluation of ischemic heart disease. International journal of cardiology 20011201
Identification of viable myocardium early after acute myocardial infarction using closed-loop arbutamine echocardiography: comparison with positron emission tomography. Acta cardiologica 20011201
Incremental prognostic value of RNA ejection fraction measurements during pharmacologic stress testing: a comparison with clinical and perfusion variables. Journal of nuclear medicine : official publication, Society of Nuclear Medicine 20010601
Arbutamine stimulation detects viable myocardium 4 weeks after coronary occlusion. Journal of the American Society of Echocardiography : official publication of the American Society of Echocardiography 20010201
[Methodological aspects of performing exercise tests used in combination with perfusion scintigraphy of the myocardium]. Terapevticheskii arkhiv 20010101
Characterization of the adrenergic activity of arbutamine, a novel agent for pharmacological stress testing. Cardiovascular drugs and therapy 19960301
Properties