RefChem:228845
TL;DR: RefChem:228845 (CAS 112446-97-6) is a chemical compound with molecular formula C26H36Cl2N2O2 and molecular weight 478.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-cyclopentylphenyl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]butan-1-one;dihydrochloride
Also Known As: 1-Butanone, 1-(4-cyclopentylphenyl)-4-(4-(4-methoxyphenyl)-1-piperazinyl)-, dihydrochloride, 1-(4-Cyclopentylphenyl)-4-(4-(4-methoxyphenyl)-1-piperazinyl)-1-butanone dihydrochloride, 1-(4-cyclopentylphenyl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]butan-1-one dihydrochloride, 1-(4-Cyclopentylphenyl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]butan-1-one--hydrogen chloride (1/2), RefChem:228845
| Molecular Formula | C26H36Cl2N2O2 |
|---|---|
| Molecular Weight | 478.22 g/mol |
| LogP | 5.9815 |
| Topological Polar Surface Area | 32.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 478.2154 |
| Heavy Atoms | 32 |
| Complexity | 812.72546 |
Chemical Identifiers
| CAS Number | 112446-97-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2CCN(CC2)CCCC(=O)C3=CC=C(C=C3)C4CCCC4.Cl.Cl |
Product Overview
RefChem:228845 (CAS 112446-97-6), with molecular formula C26H36Cl2N2O2 and molecular weight 478.22 g/mol. IUPAC: 1-(4-cyclopentylphenyl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]butan-1-one;dihydrochloride.
Chemical Property Profile of RefChem:228845
Property Insights of RefChem:228845
The XLogP value of 5.9815 indicates that RefChem:228845 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:228845 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:228845 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:228845?
The CAS number of RefChem:228845 is 112446-97-6.
What is the molecular formula of RefChem:228845?
The molecular formula of RefChem:228845 is C26H36Cl2N2O2.
What is the molecular weight of RefChem:228845?
The molecular weight of RefChem:228845 is 478.22 g/mol.
Where can I buy RefChem:228845?
You can request a quote for RefChem:228845 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:228845?
Yes, KEHONG BIO provides custom synthesis services for RefChem:228845 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.