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Quiflapon structure
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Quiflapon

TL;DR: Quiflapon (CAS 136668-42-3) is a chemical compound with molecular formula C34H35ClN2O3S and molecular weight 586.2057 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-[3-tert-butylsulfanyl-1-[(4-chlorophenyl)methyl]-5-(quinolin-2-ylmethoxy)indol-2-yl]-2,2-dimethylpropanoic acid

Also Known As: Quiflapon, Quiflapon [INN], quiflaponum, betulinic acid, Quiflapon free acid

CAS Number
136668-42-3
Molecular Formula
C34H35ClN2O3S
Molecular Weight
586.2057 g/mol
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Application Areas

Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (3 patents) Analytical Reagents (2 patents) Biotechnology (5 patents) Heterocyclic Building Blocks (34 patents) Organic Building Blocks (3 patents)

Technical Specifications

Molecular FormulaC34H35ClN2O3S
Molecular Weight586.2057 g/mol
XLogP8.2
Topological Polar Surface Area (TPSA)89.7 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors5
Rotatable Bonds10
Exact Mass586.2057 Da
Heavy Atoms41
Complexity873.0
SMILESCC(C)(C)SC1=C(N(C2=C1C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)CC5=CC=C(C=C5)Cl)CC(C)(C)C(=O)O
InChIKeyNZOONKHCNQFYCI-UHFFFAOYSA-N

Chemical Property Profile of Quiflapon

XLogP
8.2
TPSA (Topological Polar Surface Area)
89.7
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
10
Heavy Atoms
41
Complexity
873.0
Exact Mass
586.2057
Monoisotopic Mass
586.2057
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 Quiflapon

The XLogP value of 8.2 indicates that Quiflapon is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Quiflapon. Following Lipinski's Rule of Five, Quiflapon has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Quiflapon?

The CAS number of Quiflapon is 136668-42-3.

What is the molecular formula of Quiflapon?

The molecular formula of Quiflapon is C34H35ClN2O3S.

What is the molecular weight of Quiflapon?

The molecular weight of Quiflapon is 586.2057 g/mol.

Where can I buy Quiflapon?

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

Does CoreyChem offer custom synthesis for Quiflapon?

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

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