Indibulin

Base Information

• Chemical Name: Indibulin
• CAS No.: 204205-90-3
• Molecular Formula: C22H16ClN3O2
• Molecular Weight: 389.83
• Hs Code.: 2933399090
• UNII: 80K4H2RB8P
• DSSTox Substance ID: DTXSID70174368
• Nikkaji Number: J1.470.271G
• Wikidata: Q27269154
• NCI Thesaurus Code: C2049
• Metabolomics Workbench ID: 149653
• ChEMBL ID: CHEMBL49642
• Mol file: 204205-90-3.mol

Synonyms:D 24851;D-24851;indibulin;N-(pyridin-4-yl)-(1-(4-chlorobenzyl)indol-3-yl)glycoxylamide;N-(pyridin-4-yl)-(1-(4-chlorobenzyl)indol-3-yl)glyoxylamide

Chemical Property of Indibulin

Chemical Property:

• Refractive Index: 1.664
• PKA: 9.38±0.70(Predicted)
• PSA: 63.99000
• Density: 1.31 g/cm³
• LogP: 4.63240
• Storage Temp.: Desiccate at -20°C
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 389.0931045
• Heavy Atom Count: 28
• Complexity: 558

Purity/Quality:

98%min ^*data from raw suppliers

Indibulin ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)Cl)C(=O)C(=O)NC4=CC=NC=C4
• Recent ClinicalTrials: Study of a Novel Indibulin Dosing Schedule for the Treatment of Metastatic Breast Cancer
• Uses: Indibulin is a microtubule destabilizer. Acts as a chemotherapeutic drug used in the treatment of breast cancer and other heterogenous and aggressive types of cancer.