Bometolol, (S)-

Base Information

Chemical Name:Bometolol, (S)-
CAS No.:79784-50-2
Molecular Formula:C₂₅H₃₂N₂O₇
Molecular Weight:472.538
Hs Code.:
UNII:52H0FYO1F5

Synonyms:Bometolol, (S)-;52H0FYO1F5;OPC 1427, (S)-;UNII-52H0FYO1F5;2(1H)-Quinolinone, 5-(3-((2-(3,4-dimethoxyphenyl)ethyl)amino)-2-hydroxypropoxy)-3,4-dihydro-8-(2-oxopropoxy)-, (S)-;79784-50-2;SCHEMBL1477806

Suppliers and Price of Bometolol, (S)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 0 raw suppliers

Chemical Property of Bometolol, (S)-

Chemical Property:

XLogP3:1.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:13
Exact Mass:472.22095136
Heavy Atom Count:34
Complexity:649

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(=O)COC1=C2C(=C(C=C1)OCC(CNCCC3=CC(=C(C=C3)OC)OC)O)CCC(=O)N2
Isomeric SMILES:CC(=O)COC1=C2C(=C(C=C1)OC[C@H](CNCCC3=CC(=C(C=C3)OC)OC)O)CCC(=O)N2

Technology Process of Bometolol, (S)-

There total 6 articles about Bometolol, (S)- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 74245-70-8
(S)(-)-8-acetonyloxy-5-<3-(N-benzyl-3,4-dimethoxyphenethylamino)-2-hydroxypropoxy>-3,4-dihydrocarbostyril

: 79784-50-2
(S)(-)-8-acetonyloxy-5-<3-(3,4-dimethoxyphenethylamino)-2-hydroxypropoxy>-3,4-dihydrocarbostyril

Guidance literature:: With sulfuric acid; hydrogen; pyrographite; palladium on activated charcoal; In water; isopropyl alcohol; Yield given; Ambient temperature;
DOI:10.1248/cpb.29.2157

Reference yield:

: 51973-93-4
N-benzyl-2-(3,4-dimethoxyphenyl)ethylamine

: 79784-50-2
(S)(-)-8-acetonyloxy-5-<3-(3,4-dimethoxyphenethylamino)-2-hydroxypropoxy>-3,4-dihydrocarbostyril

Guidance literature:: Multi-step reaction with 3 steps

1: 2.) conc. HCl / 1.) methanol, 4.5 h, reflux, 2.) acetone, 20 min, ice bath, overnight, room temperature

2: 1.) NaHCO₃, 2.) K₂CO₃ / acetone; H₂O / 2 h / Heating

3: hydrogen, charcoal, 10percent H₂SO₄ / 10percent Pd-C / propan-2-ol; H₂O / Ambient temperature

With hydrogenchloride; sulfuric acid; hydrogen; sodium hydrogencarbonate; potassium carbonate; pyrographite; palladium on activated charcoal; In water; isopropyl alcohol; acetone;
DOI:10.1248/cpb.29.2157

Reference yield:

: 79784-54-6
5-hydroxy-8-(2-tetrahydropyranyloxy)-3,4-dihydrocarbostyril

: 79784-50-2
(S)(-)-8-acetonyloxy-5-<3-(3,4-dimethoxyphenethylamino)-2-hydroxypropoxy>-3,4-dihydrocarbostyril

Guidance literature:: Multi-step reaction with 5 steps

1: 21 percent / piperidine / dimethylformamide / 9.5 h / 60 - 65 °C

2: 83 percent / 3.5N KOH / methanol / 1 h / Ambient temperature

3: 2.) conc. HCl / 1.) methanol, 4.5 h, reflux, 2.) acetone, 20 min, ice bath, overnight, room temperature

4: 1.) NaHCO₃, 2.) K₂CO₃ / acetone; H₂O / 2 h / Heating

5: hydrogen, charcoal, 10percent H₂SO₄ / 10percent Pd-C / propan-2-ol; H₂O / Ambient temperature

With piperidine; hydrogenchloride; potassium hydroxide; sulfuric acid; hydrogen; sodium hydrogencarbonate; potassium carbonate; pyrographite; palladium on activated charcoal; In methanol; water; N,N-dimethyl-formamide; isopropyl alcohol; acetone;
DOI:10.1248/cpb.29.2157