Ruboxistaurin mesylate

Base Information

• Chemical Name: Ruboxistaurin mesylate
• CAS No.: 192050-59-2
• Molecular Formula: C29H32N4O6S
• Molecular Weight: 564.65258
• UNII: 6V860VW8AO
• ChEMBL ID: CHEMBL432130
• DSSTox Substance ID: DTXSID10172762
• Wikidata: Q27265576
• Mol file: 192050-59-2.mol

Synonyms:Ruboxistaurin mesylate;192050-59-2;Ruboxistaurin mesilate;LY 333531 mesylate;6V860VW8AO;Ruboxistaurin (mesylate);9-((Dimethylamino)methyl)-6,7,10,11-tetrahydro-9H,18H-5,21:12,17-dimethenodibenzo(E,k)pyrrolo(3,4-h)(1,4,13)oxadiazacyclohexadecine-18,20(19H)-dione, methanesulfonate, (9S)-;CHEMBL432130;(18S)-18-[(dimethylamino)methyl]-17-oxa-4,14,21-triazahexacyclo[19.6.1.17,14.02,6.08,13.022,27]nonacosa-1(28),2(6),7(29),8,10,12,22,24,26-nonaene-3,5-dione;methanesulfonic acid;UNII-6V860VW8AO;Ruboxistaurinmesylate;DTXSID10172762;AMY20618;HY-10195A;AKOS040755510;RUBOXISTAURIN MESILATE [WHO-DD];CS-0006801;F21489;RUBOXISTAURIN METHANESULFONATE ANHYDROUS [MI];Q27265576;(7S)-7-((Dimethylamino)methyl)-22,25-dihydro-11H,21H,31H-6-oxa-1,3(3,1)-diindola-2(3,4)-pyrrolacyclononaphane-22,25-dione methanesulfonate;13-((Dimethylamino)methyl)-10,11,14,15-tetrahydro-4,9:16,21 -dimetheno-1H,13H-dibenzo(e,k)pyrrolo(3,4-h)(1,4,13) oxadiazacyclohexadecene-1,3(2H)-dione methanesulfonate

Chemical Property of Ruboxistaurin mesylate

Chemical Property:

• PSA: 134.74000
• LogP: 4.37440
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 564.20425593
• Heavy Atom Count: 40
• Complexity: 965

Purity/Quality:

97% ^*data from raw suppliers

LY333531mesylate-Ruboxistaurin 99% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CC1CCN2C=C(C3=CC=CC=C32)C4=C(C5=CN(CCO1)C6=CC=CC=C65)C(=O)NC4=O.CS(=O)(=O)O
• Isomeric SMILES: CN(C)C[C@@H]1CCN2C=C(C3=CC=CC=C32)C4=C(C5=CN(CCO1)C6=CC=CC=C65)C(=O)NC4=O.CS(=O)(=O)O
• Recent ClinicalTrials: Treatment for Symptomatic Peripheral Neuropathy in Patients With Diabetes

Technology Process of Ruboxistaurin mesylate

There total 7 articles about Ruboxistaurin mesylate 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: 72.0%

methanesulfonic acid (75-75-2,98527-29-8) + (9S)-9-[(dimethylamino)methyl]-6,7,10,11-tetrahydro-9H,18H-5,21:12,17-dimethenodibenzo[e,k]pyrrolo[3,4-h][1,4,13]-oxadiazacyclohexadecine-18,20(19H)-dione hydrate → Ruboxistaurin mesylate (192050-59-2)

Guidance literature:

In water; acetone; at 20 ℃; for 0.25h;

DOI:10.1021/acschemneuro.8b00196

Reference yield:

bisindolylmaleimide V (113963-68-1) → Ruboxistaurin mesylate (192050-59-2)

Guidance literature:

Multi-step reaction with 7 steps

1: caesium carbonate / N,N-dimethyl-formamide / 17 h / 100 °C

2: potassium hydroxide / ethanol / 22 h / Reflux

3: methanol; N,N-dimethyl-formamide / 5 h / 80 °C

4: hydrogenchloride / water; ethanol / 2 h / Reflux

5: pyridine / tetrahydrofuran / 1.5 h / 70 °C

6: water / N,N-dimethyl-formamide / 22 h / 60 °C / Sealed tube

7: water; acetone / 0.25 h / 20 °C

With pyridine; hydrogenchloride; water; caesium carbonate; potassium hydroxide; In tetrahydrofuran; methanol; ethanol; water; N,N-dimethyl-formamide; acetone;

DOI:10.1021/acschemneuro.8b00196

Reference yield:

(9S)-6,7,10,11-tetrahydro-19-methyl-9-[(triphenylmethoxy)-methyl]-9H,18H-5,21:12,17-dimethenodibenzo[e,k]pyrrolo[3,4-h]-[1,4,13]oxadiazacyclohexadecine-18,20(19H)-dione (170277-74-4) → Ruboxistaurin mesylate (192050-59-2)

Guidance literature:

Multi-step reaction with 6 steps

1: potassium hydroxide / ethanol / 22 h / Reflux

2: methanol; N,N-dimethyl-formamide / 5 h / 80 °C

3: hydrogenchloride / water; ethanol / 2 h / Reflux

4: pyridine / tetrahydrofuran / 1.5 h / 70 °C

5: water / N,N-dimethyl-formamide / 22 h / 60 °C / Sealed tube

6: water; acetone / 0.25 h / 20 °C

With pyridine; hydrogenchloride; water; potassium hydroxide; In tetrahydrofuran; methanol; ethanol; water; N,N-dimethyl-formamide; acetone;

DOI:10.1021/acschemneuro.8b00196

upstream raw materials:

bisindolylmaleimide V

(9S)-6,7,10,11-tetrahydro-19-methyl-9-[(triphenylmethoxy)-methyl]-9H,18H-5,21:12,17-dimethenodibenzo[e,k]pyrrolo[3,4-h]-[1,4,13]oxadiazacyclohexadecine-18,20(19H)-dione

(9S)-6,7,10,11-tetrahydro-9-[(triphenylmethoxy)methyl]-5,21:12,17-dimetheno-9H-dibenzo[e,k]furo[3,4-h][1,4,13]-oxadiazacyclohexadecine-18,20-dione

(9S)-6,7,10,11-tetrahydro-9-[(triphenylmethoxy)methyl]-9H,18H-5,21:12,17-dimethenodibenzo[e,k]pyrrolo[3,4-h][1,4,13]-oxadiazacyclohexadecine-18,20(19H)-dione

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 192050-59-2 (9S)-9-[(Dimethylamino)methyl]-6,7,10,11-tetrahydro-9H,18H-5,21:12,17-dimethenodibenzo[e,k]pyrrolo[3,4-h][1,4,13]oxadiazacyclohexadecine-18,20(19H)-dione methanesulfonate

Send

Send

Metric Ton KG G Pound L ML

Send

Send