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Indibulin structure
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Indibulin

TL;DR: Indibulin (CAS 204205-90-3) is a chemical compound with molecular formula C22H16ClN3O2 and molecular weight 389.0931 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxo-N-pyridin-4-ylacetamide

Also Known As: Indibulin, Indibulina, Indibuline, indibulinum, Indibulin [INN]

CAS Number
204205-90-3
Molecular Formula
C22H16ClN3O2
Molecular Weight
389.0931 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (29 patents) Pharmaceutical Intermediates (57 patents)

Technical Specifications

Molecular FormulaC22H16ClN3O2
Molecular Weight389.0931 g/mol
XLogP3.9
Topological Polar Surface Area (TPSA)64.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds5
Exact Mass389.0931 Da
Heavy Atoms28
Complexity558.0
SMILESC1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)Cl)C(=O)C(=O)NC4=CC=NC=C4
InChIKeySOLIIYNRSAWTSQ-UHFFFAOYSA-N

Product Description

Applications: Indibulin is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Indibulin (CAS 204205-90-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

A pharmaceutical intermediate supplied by CoreyChem, Indibulin (CAS 204205-90-3) has the molecular formula C22H16ClN3O2 and a molecular weight of 389.09 g/mol. It is also known as Indibulin and Indibulina.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Indibulin

XLogP
3.9
TPSA (Topological Polar Surface Area)
64.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
5
Heavy Atoms
28
Complexity
558.0
Exact Mass
389.0931
Monoisotopic Mass
389.0931
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Indibulin

The XLogP value of 3.9 indicates that Indibulin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Indibulin. Following Lipinski's Rule of Five, Indibulin has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Indibulin?

The CAS number of Indibulin is 204205-90-3.

What is the molecular formula of Indibulin?

The molecular formula of Indibulin is C22H16ClN3O2.

What is the molecular weight of Indibulin?

The molecular weight of Indibulin is 389.0931 g/mol.

What are the applications of Indibulin?

Indibulin is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Indibulin (CAS 204205-90-3) with custom...

Where can I buy Indibulin?

You can request a quote for Indibulin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Indibulin?

Yes, CoreyChem provides custom synthesis services for Indibulin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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