Obatoclax

Base Information

Chemical Name:Obatoclax
CAS No.:803712-67-6
Molecular Formula:C₂₀H₁₉N₃O
Molecular Weight:317.39
Hs Code.:
UNII:QN4128B52A
ChEMBL ID:CHEMBL408194,CHEMBL4802292,CHEMBL4525540
Metabolomics Workbench ID:153224
NCI Thesaurus Code:C60770
Pharos Ligand ID:XCLYS95UPJ79
Wikidata:Q76421489
Wikipedia:Obatoclax

Synonyms:1H-indole, 2-(2-((3,5-dimethyl-1H-pyrrol-2-yl)methylene)-3-methoxy-2H-pyrrol-5-yl)-;2-((2Z)-2-((3,5-Dimethyl-1H-pyrrol-2-yl)methylene)-3-methoxy-2H-pyrrol-5-yl)-1H-indole methanesulfonate (1:1);2-(2-((3,5-dimethyl-1H-pyrrol-2-yl)methylene)-3-methoxy-2H-pyrrol-5-yl)-1H-indole;2-(2-((3,5-Dimethyl-1H-pyrrol-2-yl)methylene)-3-methoxy-2H-pyrrol-5-yl)-1H-indole methanesulfonate;GX 15-070;GX-15-070;GX015-070;GX15-070;obatoclax;obatoclax mesylate

Suppliers and Price of Obatoclax

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
Packaging
price

TRC
Obatoclax
50mg
$ 100.00

Total 21 raw suppliers

Chemical Property of Obatoclax

Chemical Property:

PSA：53.17000
LogP:3.92250
XLogP3:3.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:317.152812238
Heavy Atom Count:24
Complexity:777

Purity/Quality:

97% ^*data from raw suppliers

Obatoclax ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=CC(=C(N1)C=C2C(=CC(=C3C=C4C=CC=CC4=N3)N2)OC)C
Isomeric SMILES:CC1=CC(=C(N1)/C=C\2/C(=C/C(=C/3\C=C4C=CC=CC4=N3)/N2)OC)C
Recent ClinicalTrials:A Phase I/II Study of Carboplatin and Etoposide With or Without Obatoclax in Extensive-stage Small Cell Lung Cancer (ES-SCLC)
Uses Obatoclax is a small molecule mimetic of the BH3 domain of BCL-2 family proteins.

Technology Process of Obatoclax

There total 16 articles about Obatoclax 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: 98.0%

: 625-82-1
2,4-dimethyl-1H-pyrrole

: 1001162-89-5
1-(N-methoxycarbonyl)indole-2-boronic acid

: 803712-67-6
obatoclax

Guidance literature:: 2,4-dimethyl-1H-pyrrole; 1-(N-methoxycarbonyl)indole-2-boronic acid; With hydrogenchloride; In methanol; at 16 - 20 ℃;

In N,N-dimethyl-formamide; for 0.333333h;
DOI:10.1021/op7001613