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3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one structure
Fine Chemical

3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one

TL;DR: 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one (CAS 186611-52-9) is a chemical compound with molecular formula C18H17NO4 and molecular weight 311.11575 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one

Also Known As: ic261, Maybridge3_000754, IC 261, IC261, SU5607, IC-261(SU-5607)

CAS Number
186611-52-9
Molecular Formula
C18H17NO4
Molecular Weight
311.11575 g/mol
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Application Areas

Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.

Analytical Reagents (1 patents) Heterocyclic Building Blocks (6 patents) Organic Building Blocks (4 patents) Pharmaceutical Intermediates (21 patents)

Technical Specifications

Molecular FormulaC18H17NO4
Molecular Weight311.11575 g/mol
XLogP2.8
Topological Polar Surface Area (TPSA)56.8 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds4
Exact Mass311.11575 Da
Heavy Atoms23
Complexity450.0
SMILESCOC1=CC(=C(C(=C1)OC)C=C2C3=CC=CC=C3NC2=O)OC
InChIKeyJBJYTZXCZDNOJW-UHFFFAOYSA-N

Product Description

Applications: 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one 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 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one (CAS 186611-52-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one is a pharmaceutical intermediate identified by CAS number 186611-52-9 and the molecular formula C18H17NO4 and a molecular weight of 311.12 g/mol. It is also known as ic261 and Maybridge3_000754.

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 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one

XLogP
2.8
TPSA (Topological Polar Surface Area)
56.8
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
4
Heavy Atoms
23
Complexity
450.0
Exact Mass
311.11575
Monoisotopic Mass
311.11575
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 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one

The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one. With a topological polar surface area (TPSA) of 56.8 Ų, 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one?

The CAS number of 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one is 186611-52-9.

What is the molecular formula of 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one?

The molecular formula of 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one is C18H17NO4.

What is the molecular weight of 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one?

The molecular weight of 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one is 311.11575 g/mol.

What are the applications of 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one?

3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one 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...

Where can I buy 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one?

You can request a quote for 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one?

Yes, CoreyChem provides custom synthesis services for 3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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