Timcodar

Base Information

• Chemical Name: Timcodar
• CAS No.: 179033-51-3
• Deprecated CAS: 190454-58-1
• Molecular Formula: C43H45ClN4O6
• Molecular Weight: 749.29
• UNII: U141W322WZ
• DSSTox Substance ID: DTXSID80870142
• Wikidata: Q27290544
• NCI Thesaurus Code: C71626
• Metabolomics Workbench ID: 153689
• ChEMBL ID: CHEMBL2059028
• Mol file: 179033-51-3.mol

Synonyms:timcodar;timcodar dimesylate;VX 853;VX-853;VX853 cpd

Chemical Property of Timcodar

Chemical Property:

• PSA: 111.16000
• LogP: 7.07120
• XLogP3: 7.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 18
• Exact Mass: 748.3027629
• Heavy Atom Count: 54
• Complexity: 1100

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C(CC1=CC=C(C=C1)Cl)C(=O)N(CC2=CC=CC=C2)C(CCC3=CC=NC=C3)CCC4=CC=NC=C4)C(=O)C(=O)C5=CC(=C(C(=C5)OC)OC)OC
• Isomeric SMILES: CN([C@@H](CC1=CC=C(C=C1)Cl)C(=O)N(CC2=CC=CC=C2)C(CCC3=CC=NC=C3)CCC4=CC=NC=C4)C(=O)C(=O)C5=CC(=C(C(=C5)OC)OC)OC
• Recent ClinicalTrials: VX-853 in Treating Patients With Solid Tumors Who Are Receiving Liposomal Doxorubicin

Technology Process of Timcodar

There total 1 articles about Timcodar 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:

→ timcodar (179033-51-3)

Guidance literature:

Refernces

• 1、 -. "Amino acid derivatives with improved multi-drug resistance activity". . . Retrieved 2008/06/13.