Dehydro Ivabradine

Base Information Edit

Chemical Name:Dehydro Ivabradine
CAS No.:1086026-31-4
Molecular Formula:C27H34N2O5
Molecular Weight:466.577
Hs Code.:
UNII:TN7CPA7CZG
DSSTox Substance ID:DTXSID90583019
Mol file:1086026-31-4.mol

Synonyms:Dehydro Ivabradine;1086026-31-4;Dehydroivabradine;TN7CPA7CZG;3-[3-[[(7S)-3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methyl-methylamino]propyl]-7,8-dimethoxy-1H-3-benzazepin-2-one;Dehydro Ivabradine (Ivabradine IVA-3 Impurity);(S)-3-(3-(((3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl)methyl)(methyl)amino)propyl)-7,8-dimethoxy-1H-benzo[d]azepin-2(3H)-one;(S)-3-(3-(((3,4-Dimethoxybicyclo(4.2.0)octa-1,3,5-trien-7-yl)methyl)(methyl)amino)propyl)-7,8-dimethoxy-1H-benzo(d)azepin-2(3H)-one;2H-3-Benzazepin-2-one, 3-(3-((((7S)-3,4-dimethoxybicyclo(4.2.0)octa-1,3,5-trien-7-yl)methyl)methylamino)propyl)-1,3-dihydro-7,8-dimethoxy-;3-(3-(((7S)-3,4-Dimethoxy-7-bicyclo(4.2.0)octa-1,3,5-trienyl)methyl-methylamino)propyl)-7,8-dimethoxy-1H-3-benzazepin-2-one;UNII-TN7CPA7CZG;SCHEMBL31280;DTXSID90583019;AQSRHFYHXNSUAO-OAQYLSRUSA-N;3-{3-[{[(7S)-3,4-dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl]methyl}(methyl)amino]-propyl}-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one;3-{3-[{[(7S)-3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl]methyl}(methyl)amino]propyl}-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one

Suppliers and Price of Dehydro Ivabradine

Supply Marketing:Edit

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
DehydroIvabradine
5mg
$ 200.00

Total 17 raw suppliers

Chemical Property of Dehydro Ivabradine Edit

Chemical Property:

PSA：60.47000
LogP:3.67610
Storage Temp.:-86°C Freezer, Under inert atmosphere
Solubility.:DMSO (Slightly), Methanol (Slightly)
XLogP3:2.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:466.24677219
Heavy Atom Count:34
Complexity:703

Purity/Quality:

99%, ^*data from raw suppliers

DehydroIvabradine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN(CCCN1C=CC2=CC(=C(C=C2CC1=O)OC)OC)CC3CC4=CC(=C(C=C34)OC)OC
Isomeric SMILES:CN(CCCN1C=CC2=CC(=C(C=C2CC1=O)OC)OC)C[C@H]3CC4=CC(=C(C=C34)OC)OC
Uses Dehydro Ivabradine is an impurity of Ivabradine (I940500)

Technology Process of Dehydro Ivabradine

There total 68 articles about Dehydro Ivabradine 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: 94.0%

: 866783-13-3
1-[(7S)-3,4-dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl]-N-methylmethanamine hydrochloride

: 148870-57-9
7,8-dimethoxy-3-[3-iodopropane]-1,3-dihydro-2H-3-benzazepin-2-one

: 1086026-31-4
3-{3-[{[(7S)-3,4-dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl]methyl}-(methyl)amino]propyl}-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one

Guidance literature:: 1-[(7S)-3,4-dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl]-N-methylmethanamine hydrochloride; With potassium carbonate; In water; at 30 ℃;

7,8-dimethoxy-3-[3-iodopropane]-1,3-dihydro-2H-3-benzazepin-2-one; In water; at 30 - 60 ℃; for 24.5h; Reagent/catalyst;