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TAK 603 structure
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TAK 603

TL;DR: TAK 603 (CAS 158146-85-1) is a chemical compound with molecular formula C25H26N4O6 and molecular weight 478.18524 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

ethyl 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-(1,2,4-triazol-1-ylmethyl)quinoline-3-carboxylate

Also Known As: TAK 603, ethyl 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-(1,2,4-triazol-1-ylmethyl)quinoline-3-carboxylate, Ethyl 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-(1H-1,2,4-triazol-1-ylmethyl)-3-quinolinecarboxylate, TAK-603, TAK603, TAK 603, 3-Quinolinecarboxylic acid, 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-(1H-1,2,4-triazol-1-ylmethyl)-, ethyl ester

CAS Number
158146-85-1
Molecular Formula
C25H26N4O6
Molecular Weight
478.18524 g/mol
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Application Areas

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

Agrochemicals (2 patents) Heterocyclic Building Blocks (26 patents) Organic Building Blocks (2 patents) Pharmaceutical Intermediates (163 patents) Polymer Intermediates (1 patents)

Technical Specifications

Molecular FormulaC25H26N4O6
Molecular Weight478.18524 g/mol
XLogP3.6
Topological Polar Surface Area (TPSA)107.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors9
Rotatable Bonds10
Exact Mass478.18524 Da
Heavy Atoms35
Complexity686.0
SMILESCCOC(=O)C1=C(C2=CC(=C(C=C2N=C1CN3C=NC=N3)OC)OC)C4=CC(=C(C=C4)OC)OC
InChIKeyCLQRMSBSMHXMMC-UHFFFAOYSA-N

Chemical Property Profile of TAK 603

XLogP
3.6
TPSA (Topological Polar Surface Area)
107.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
9
Rotatable Bonds
10
Heavy Atoms
35
Complexity
686.0
Exact Mass
478.18524
Monoisotopic Mass
478.18524
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 TAK 603

The XLogP value of 3.6 indicates that TAK 603 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for TAK 603. Following Lipinski's Rule of Five, TAK 603 has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of TAK 603?

The CAS number of TAK 603 is 158146-85-1.

What is the molecular formula of TAK 603?

The molecular formula of TAK 603 is C25H26N4O6.

What is the molecular weight of TAK 603?

The molecular weight of TAK 603 is 478.18524 g/mol.

Where can I buy TAK 603?

You can request a quote for TAK 603 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for TAK 603?

Yes, CoreyChem provides custom synthesis services for TAK 603 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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