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F1125-0052 structure
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F1125-0052

TL;DR: F1125-0052 (CAS 1052525-57-1) is a chemical compound with molecular formula C20H33ClN2O4 and molecular weight 400.2129 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

ethyl 4-[3-(2-butan-2-ylphenoxy)-2-hydroxypropyl]piperazine-1-carboxylate;hydrochloride

Also Known As: F1125-0052, ethyl 4-(3-(2-(sec-butyl)phenoxy)-2-hydroxypropyl)piperazine-1-carboxylate hydrochloride, ethyl 4-[3-(2-butan-2-ylphenoxy)-2-hydroxypropyl]piperazine-1-carboxylate hydrochloride, ethyl 4-[3-(2-butan-2-ylphenoxy)-2-hydroxypropyl]piperazine-1-carboxylate;hydrochloride

CAS Number
1052525-57-1
Molecular Formula
C20H33ClN2O4
Molecular Weight
400.2129 g/mol
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Technical Specifications

Molecular FormulaC20H33ClN2O4
Molecular Weight400.2129 g/mol
XLogP3.1357
Topological Polar Surface Area (TPSA)62.2 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors6
Rotatable Bonds9
Exact Mass400.2129 Da
Heavy Atoms27
Complexity413.0
SMILESCCC(C)C1=CC=CC=C1OCC(CN2CCN(CC2)C(=O)OCC)O.Cl
InChIKeyXTURKZLTEOJXAP-UHFFFAOYSA-N

Chemical Property Profile of F1125-0052

XLogP
3.1357
TPSA (Topological Polar Surface Area)
62.2
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
9
Heavy Atoms
27
Complexity
413.0
Exact Mass
400.2129
Monoisotopic Mass
400.2129
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 F1125-0052

The XLogP value of 3.1357 indicates that F1125-0052 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for F1125-0052. Following Lipinski's Rule of Five, F1125-0052 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of F1125-0052?

The CAS number of F1125-0052 is 1052525-57-1.

What is the molecular formula of F1125-0052?

The molecular formula of F1125-0052 is C20H33ClN2O4.

What is the molecular weight of F1125-0052?

The molecular weight of F1125-0052 is 400.2129 g/mol.

Where can I buy F1125-0052?

You can request a quote for F1125-0052 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for F1125-0052?

Yes, CoreyChem provides custom synthesis services for F1125-0052 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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