12P-056
TL;DR: 12P-056 (CAS 477709-66-3) is a chemical compound with molecular formula C24H18F2N2O2 and molecular weight 404.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-fluorophenyl)-[3-[1-(3-fluoro-4-phenylphenoxy)ethyl]pyrazol-1-yl]methanone
Also Known As: 12P-056, (3-{1-[(2-fluoro[1,1'-biphenyl]-4-yl)oxy]ethyl}-1H-pyrazol-1-yl)(4-fluorophenyl)methanone, (4-fluorophenyl)-[3-[1-(3-fluoro-4-phenylphenoxy)ethyl]pyrazol-1-yl]methanone, 3-[1-({2-fluoro-[1,1'-biphenyl]-4-yl}oxy)ethyl]-1-(4-fluorobenzoyl)-1H-pyrazole, 3-[1-({2-fluoro-[1,1'-biphenyl]-4-yl}oxy)ethyl]-1-(4-fluorobenzoyl)pyrazole
| Molecular Formula | C24H18F2N2O2 |
|---|---|
| Molecular Weight | 404.13 g/mol |
| LogP | 5.6568 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 404.13364 |
| Heavy Atoms | 30 |
| Complexity | 1171.5524 |
Chemical Identifiers
| CAS Number | 477709-66-3 |
|---|---|
| SMILES | CC(C1=NN(C=C1)C(=O)C2=CC=C(C=C2)F)OC3=CC(=C(C=C3)C4=CC=CC=C4)F |
Product Overview
12P-056 (CAS 477709-66-3), with molecular formula C24H18F2N2O2 and molecular weight 404.13 g/mol. IUPAC: (4-fluorophenyl)-[3-[1-(3-fluoro-4-phenylphenoxy)ethyl]pyrazol-1-yl]methanone.
Chemical Property Profile of 12P-056
Property Insights of 12P-056
The XLogP value of 5.6568 indicates that 12P-056 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.12 Ų, 12P-056 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 12P-056 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 12P-056?
The CAS number of 12P-056 is 477709-66-3.
What is the molecular formula of 12P-056?
The molecular formula of 12P-056 is C24H18F2N2O2.
What is the molecular weight of 12P-056?
The molecular weight of 12P-056 is 404.13 g/mol.
Where can I buy 12P-056?
You can request a quote for 12P-056 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 12P-056?
Yes, KEHONG BIO provides custom synthesis services for 12P-056 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.