7J-004
TL;DR: 7J-004 (CAS 344277-92-5) is a chemical compound with molecular formula C22H19ClF3N3O3S and molecular weight 497.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]sulfonyl-4-phenylpiperazine
Also Known As: 7J-004, 1-[(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl)sulfonyl]-4-phenylpiperazine, 1-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}benzenesulfonyl)-4-phenylpiperazine, 1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]sulfonyl-4-phenylpiperazine, 1-((4-(3-Chloro-5-(trifluoromethyl)-2-pyridinyl)oxy)phenyl)sulfonyl)-4-phenylpiperazine
| Molecular Formula | C22H19ClF3N3O3S |
|---|---|
| Molecular Weight | 497.08 g/mol |
| LogP | 5.057 |
| Topological Polar Surface Area | 62.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 497.07877 |
| Heavy Atoms | 33 |
| Complexity | 1215.1287 |
Chemical Identifiers
| CAS Number | 344277-92-5 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC4=C(C=C(C=N4)C(F)(F)F)Cl |
Product Overview
7J-004 (CAS 344277-92-5), with molecular formula C22H19ClF3N3O3S and molecular weight 497.08 g/mol. IUPAC: 1-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]sulfonyl-4-phenylpiperazine.
Chemical Property Profile of 7J-004
Property Insights of 7J-004
The XLogP value of 5.057 indicates that 7J-004 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 7J-004. Following Lipinski's Rule of Five, 7J-004 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7J-004?
The CAS number of 7J-004 is 344277-92-5.
What is the molecular formula of 7J-004?
The molecular formula of 7J-004 is C22H19ClF3N3O3S.
What is the molecular weight of 7J-004?
The molecular weight of 7J-004 is 497.08 g/mol.
Where can I buy 7J-004?
You can request a quote for 7J-004 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7J-004?
Yes, KEHONG BIO provides custom synthesis services for 7J-004 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.