RefChem:228928
TL;DR: RefChem:228928 (CAS 51934-59-9) is a chemical compound with molecular formula C24H33Cl2FN2O2 and molecular weight 470.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[2-(3,5-dimethylphenoxy)ethyl]piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one;dihydrochloride
Also Known As: 1-Butanone, 4-(4-(2-(3,5-dimethylphenoxy)ethyl)-1-piperazinyl)-1-(4-fluorophenyl)-, dihydrochloride, 4-[4-[2-(3,5-dimethylphenoxy)ethyl]piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one Dihydrochloride, 4-{4-[2-(3,5-Dimethylphenoxy)ethyl]piperazin-1-yl}-1-(4-fluorophenyl)butan-1-one--hydrogen chloride (1/2), RefChem:228928
| Molecular Formula | C24H33Cl2FN2O2 |
|---|---|
| Molecular Weight | 470.19 g/mol |
| LogP | 4.94564 |
| Topological Polar Surface Area | 32.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 470.1903 |
| Heavy Atoms | 31 |
| Complexity | 789.4766 |
Chemical Identifiers
| CAS Number | 51934-59-9 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)OCCN2CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C.Cl.Cl |
Product Overview
RefChem:228928 (CAS 51934-59-9), with molecular formula C24H33Cl2FN2O2 and molecular weight 470.19 g/mol. IUPAC: 4-[4-[2-(3,5-dimethylphenoxy)ethyl]piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one;dihydrochloride.
Chemical Property Profile of RefChem:228928
Property Insights of RefChem:228928
The XLogP value of 4.94564 indicates that RefChem:228928 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.78 Ų, RefChem:228928 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:228928 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:228928?
The CAS number of RefChem:228928 is 51934-59-9.
What is the molecular formula of RefChem:228928?
The molecular formula of RefChem:228928 is C24H33Cl2FN2O2.
What is the molecular weight of RefChem:228928?
The molecular weight of RefChem:228928 is 470.19 g/mol.
Where can I buy RefChem:228928?
You can request a quote for RefChem:228928 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:228928?
Yes, KEHONG BIO provides custom synthesis services for RefChem:228928 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.