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8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate structure
Fine Chemical

8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate

TL;DR: 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate (CAS 89565-68-4) is a chemical compound with molecular formula C17H20N2O2 and molecular weight 284.15247 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 1H-indole-3-carboxylate

Also Known As: tropisetron, Tropisetronum, Tropisetron (racemic), Tropisetron [BAN:INN], Tropisetron [INN:BAN]

CAS Number
89565-68-4
Molecular Formula
C17H20N2O2
Molecular Weight
284.15247 g/mol
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Application Areas

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

Agrochemicals (6 patents) Heterocyclic Building Blocks (38 patents) Organic Building Blocks (1 patents) Organometallic Reagents (1 patents) Pharmaceutical Intermediates (164 patents)

Technical Specifications

Molecular FormulaC17H20N2O2
Molecular Weight284.15247 g/mol
XLogP3.8
Topological Polar Surface Area (TPSA)45.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds3
Exact Mass284.15247 Da
Heavy Atoms21
Complexity400.0
SMILESCN1C2CCC1CC(C2)OC(=O)C3=CNC4=CC=CC=C43
InChIKeyZNRGQMMCGHDTEI-UHFFFAOYSA-N

Product Description

Applications: 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate 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 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate (CAS 89565-68-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate is a pharmaceutical intermediate identified by CAS number 89565-68-4 and the molecular formula C17H20N2O2 and a molecular weight of 284.15 g/mol. It is also known as tropisetron and Tropisetronum.

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 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate

XLogP
3.8
TPSA (Topological Polar Surface Area)
45.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
3
Heavy Atoms
21
Complexity
400.0
Exact Mass
284.15247
Monoisotopic Mass
284.15247
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 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate

The XLogP value of 3.8 indicates that 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.3 Ų, 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate 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 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate?

The CAS number of 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate is 89565-68-4.

What is the molecular formula of 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate?

The molecular formula of 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate is C17H20N2O2.

What is the molecular weight of 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate?

The molecular weight of 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate is 284.15247 g/mol.

What are the applications of 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate?

8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate 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...

Where can I buy 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate?

You can request a quote for 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate?

Yes, CoreyChem provides custom synthesis services for 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 1H-indole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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