RefChem:373100
TL;DR: RefChem:373100 (CAS 59594-29-5) is a chemical compound with molecular formula C24H31Cl3FN3O and molecular weight 501.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chlorophenyl)-[4-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]piperidin-1-yl]methanone;dihydrochloride
Also Known As: Piperidine, 1-(4-chlorobenzoyl)-4-(2-(4-(4-fluorophenyl)-1-piperazinyl)ethyl)-, dihydrochloride, 1-(4-Chlorobenzoyl)-4-(2-(4-(4-fluorophenyl)piperazinyl)ethyl)piperidine dihydrochloride, (4-Chlorophenyl)(4-{2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl}piperidin-1-yl)methanone--hydrogen chloride (1/2), (4-chlorophenyl)-[4-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]piperidin-1-yl]methanone dihydrochloride, RefChem:373100
| Molecular Formula | C24H31Cl3FN3O |
|---|---|
| Molecular Weight | 501.15 g/mol |
| LogP | 5.3872 |
| Topological Polar Surface Area | 26.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 501.15167 |
| Heavy Atoms | 32 |
| Complexity | 834.5729 |
Chemical Identifiers
| CAS Number | 59594-29-5 |
|---|---|
| SMILES | C1CN(CCC1CCN2CCN(CC2)C3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)Cl.Cl.Cl |
Product Overview
RefChem:373100 (CAS 59594-29-5), with molecular formula C24H31Cl3FN3O and molecular weight 501.15 g/mol. IUPAC: (4-chlorophenyl)-[4-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]piperidin-1-yl]methanone;dihydrochloride.
Chemical Property Profile of RefChem:373100
Property Insights of RefChem:373100
The XLogP value of 5.3872 indicates that RefChem:373100 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.79 Ų, RefChem:373100 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:373100 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:373100?
The CAS number of RefChem:373100 is 59594-29-5.
What is the molecular formula of RefChem:373100?
The molecular formula of RefChem:373100 is C24H31Cl3FN3O.
What is the molecular weight of RefChem:373100?
The molecular weight of RefChem:373100 is 501.15 g/mol.
Where can I buy RefChem:373100?
You can request a quote for RefChem:373100 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:373100?
Yes, KEHONG BIO provides custom synthesis services for RefChem:373100 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.