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Soluflazine structure
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Soluflazine

TL;DR: Soluflazine (CAS 126077-91-6) is a chemical compound with molecular formula C28H32Cl4FN5O2 and molecular weight 629.1294 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-[2-(2,6-dichloroanilino)-2-oxoethyl]-1-[4-(4-fluorophenyl)-4-pyridin-3-ylbutyl]piperazine-2-carboxamide;dihydrochloride

Also Known As: Soluflazine, R-64719, R 64719, methyl 3-(5-methyl-1H-pyrazol-3-yl)propanoate, 1-Piperazineacetamide,3-(aminocarbonyl)-N-(2,6-dichlorophenyl)-4-[4-(4-fluorophenyl)-4-(3-pyridinyl)butyl]-,hydrochloride (1:2)

CAS Number
126077-91-6
Molecular Formula
C28H32Cl4FN5O2
Molecular Weight
629.1294 g/mol
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Technical Specifications

Molecular FormulaC28H32Cl4FN5O2
Molecular Weight629.1294 g/mol
XLogP5.3934
Topological Polar Surface Area (TPSA)91.6 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors6
Rotatable Bonds10
Exact Mass629.1294 Da
Heavy Atoms40
Complexity762.0
SMILESC1CN(C(CN1CC(=O)NC2=C(C=CC=C2Cl)Cl)C(=O)N)CCCC(C3=CC=C(C=C3)F)C4=CN=CC=C4.Cl.Cl
InChIKeyKQZLAOQGNIIITJ-UHFFFAOYSA-N

Chemical Property Profile of Soluflazine

XLogP
5.3934
TPSA (Topological Polar Surface Area)
91.6
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
6
Rotatable Bonds
10
Heavy Atoms
40
Complexity
762.0
Exact Mass
629.1294
Monoisotopic Mass
629.1294
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 Soluflazine

The XLogP value of 5.3934 indicates that Soluflazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Soluflazine. Following Lipinski's Rule of Five, Soluflazine has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Soluflazine?

The CAS number of Soluflazine is 126077-91-6.

What is the molecular formula of Soluflazine?

The molecular formula of Soluflazine is C28H32Cl4FN5O2.

What is the molecular weight of Soluflazine?

The molecular weight of Soluflazine is 629.1294 g/mol.

Where can I buy Soluflazine?

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

Does CoreyChem offer custom synthesis for Soluflazine?

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

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