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CTK4B5297 structure
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CTK4B5297

TL;DR: CTK4B5297 (CAS 126661-34-5) is a chemical compound with molecular formula C26H30N2O7 and molecular weight 482.2053 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

but-2-enedioic acid;N-[4-[2-[2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]ethynyl]phenyl]formamide

Also Known As: Formamide, N-(4-((2-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)ethynyl)phenyl)-, (E)-2-butenedioate (1:1)(salt), N-[4-[2-[2-[2-HYDROXY-3-(TERT-BUTYLAMINO)PROPOXY]PHENYL]ETHYNYL]PHENYL]FORMAMIDE MALEATE

CAS Number
126661-34-5
Molecular Formula
C26H30N2O7
Molecular Weight
482.2053 g/mol
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Technical Specifications

Molecular FormulaC26H30N2O7
Molecular Weight482.2053 g/mol
XLogP2.4943
Topological Polar Surface Area (TPSA)145.0 Ų
Hydrogen Bond Donors5
Hydrogen Bond Acceptors8
Rotatable Bonds11
Exact Mass482.2053 Da
Heavy Atoms35
Complexity628.0
SMILESCC(C)(C)NCC(COC1=CC=CC=C1C#CC2=CC=C(C=C2)NC=O)O.C(=CC(=O)O)C(=O)O
InChIKeySEEFMMVHRDFGRV-UHFFFAOYSA-N

Chemical Property Profile of CTK4B5297

XLogP
2.4943
TPSA (Topological Polar Surface Area)
145.0
Hydrogen Bond Donors
5
Hydrogen Bond Acceptors
8
Rotatable Bonds
11
Heavy Atoms
35
Complexity
628.0
Exact Mass
482.2053
Monoisotopic Mass
482.2053
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 CTK4B5297

The XLogP value of 2.4943 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK4B5297. The TPSA of 145.0 Ų indicates high polarity, suggesting CTK4B5297 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK4B5297 has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of CTK4B5297?

The CAS number of CTK4B5297 is 126661-34-5.

What is the molecular formula of CTK4B5297?

The molecular formula of CTK4B5297 is C26H30N2O7.

What is the molecular weight of CTK4B5297?

The molecular weight of CTK4B5297 is 482.2053 g/mol.

Where can I buy CTK4B5297?

You can request a quote for CTK4B5297 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for CTK4B5297?

Yes, CoreyChem provides custom synthesis services for CTK4B5297 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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