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83688-85-1

83688-85-1 | 1-(tert-butylamino)-3-(3,4-dihydro-2h-thiochromen-8-yloxy)propan-2-ol hydrochloride(1:1)

CAS No: 83688-85-1 Catalog No: AG004Y1J MDL No:

Product Description

Catalog Number:
AG004Y1J
Chemical Name:
1-(tert-butylamino)-3-(3,4-dihydro-2h-thiochromen-8-yloxy)propan-2-ol hydrochloride(1:1)
CAS Number:
83688-85-1
Molecular Formula:
C16H26ClNO2S
Molecular Weight:
331.9011
IUPAC Name:
1-(tert-butylamino)-3-(3,4-dihydro-2H-thiochromen-8-yloxy)propan-2-ol;hydrochloride
InChI:
InChI=1S/C16H25NO2S.ClH/c1-16(2,3)17-10-13(18)11-19-14-8-4-6-12-7-5-9-20-15(12)14;/h4,6,8,13,17-18H,5,7,9-11H2,1-3H3;1H
InChI Key:
LPBCJDNVLKNRAZ-UHFFFAOYSA-N
SMILES:
OC(COc1cccc2c1SCCC2)CNC(C)(C)C.Cl

Properties

Complexity:
293  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.137g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
331.899g/mol
Monoisotopic Mass:
331.137g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

Literature

Title Journal
Stereoselective HPLC analysis of tertatolol in rat plasma using macrocyclic antibiotic chiral stationary phase. Chirality 20110401
Exercise-induced lipid mobilization in subcutaneous adipose tissue is mainly related to natriuretic peptides in overweight men. American journal of physiology. Endocrinology and metabolism 20080801
Atrial natriuretic peptide contributes to physiological control of lipid mobilization in humans. FASEB journal : official publication of the Federation of American Societies for Experimental Biology 20040501
Amlodipine reduces cyclosporin-induced hyperuricaemia in hypertensive renal transplant recipients. Nephrology, dialysis, transplantation : official publication of the European Dialysis and Transplant Association - European Renal Association 20031001
Mechanism of action of flibanserin in the learned helplessness paradigm in rats. European journal of pharmacology 20011214
Renal and systemic effects of atenolol and tertatolol in renal transplant recipients on cyclosporine A. Nephrology, dialysis, transplantation : official publication of the European Dialysis and Transplant Association - European Renal Association 19980201
Post-synaptic 5-HT1A receptor involvement in yawning and penile erections induced by apomorphine, physostigmine and mCPP in rats. Psychopharmacology 19950801
Nicardipine decreases blood pressure and heart rate at nucleus tractus solitarii of spontaneously hypertensive rats. Journal of cardiovascular pharmacology 19891101

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