4W-0856
TL;DR: 4W-0856 (CAS 866019-26-3) is a chemical compound with molecular formula C23H25F4N3O2 and molecular weight 451.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-(4-ethylphenyl)-3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl]-2,2,2-trifluoroacetamide
Also Known As: 4W-0856, N-{1-(4-ethylphenyl)-3-[4-(2-fluorophenyl)piperazino]-3-oxopropyl}-2,2,2-trifluoroacetamide, N-[1-(4-ethylphenyl)-3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl]-2,2,2-trifluoroacetamide, N-[1-(4-Ethylphenyl)-3-[4-(2-fluorophenyl)-1-piperazinyl]-3-oxopropyl]-2,2,2-trifluoroacetamide, N-[1-(4-ethylphenyl)-3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxo-propyl]-2,2,2-trifluoro-acetamide
| Molecular Formula | C23H25F4N3O2 |
|---|---|
| Molecular Weight | 451.19 g/mol |
| LogP | 3.8466 |
| Topological Polar Surface Area | 52.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 451.1883 |
| Heavy Atoms | 32 |
| Complexity | 939.00287 |
Chemical Identifiers
| CAS Number | 866019-26-3 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C(CC(=O)N2CCN(CC2)C3=CC=CC=C3F)NC(=O)C(F)(F)F |
Product Overview
4W-0856 (CAS 866019-26-3), with molecular formula C23H25F4N3O2 and molecular weight 451.19 g/mol. IUPAC: N-[1-(4-ethylphenyl)-3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl]-2,2,2-trifluoroacetamide.
Chemical Property Profile of 4W-0856
Property Insights of 4W-0856
The XLogP value of 3.8466 indicates that 4W-0856 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.65 Ų, 4W-0856 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4W-0856 has 1 hydrogen bond donor(s) and 3 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 4W-0856?
The CAS number of 4W-0856 is 866019-26-3.
What is the molecular formula of 4W-0856?
The molecular formula of 4W-0856 is C23H25F4N3O2.
What is the molecular weight of 4W-0856?
The molecular weight of 4W-0856 is 451.19 g/mol.
Where can I buy 4W-0856?
You can request a quote for 4W-0856 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4W-0856?
Yes, KEHONG BIO provides custom synthesis services for 4W-0856 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.