7J-005
TL;DR: 7J-005 (CAS 344277-97-0) is a chemical compound with molecular formula C17H17ClF3N3O3S and molecular weight 435.06 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-methylpiperazine
Also Known As: 7J-005, 1-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}benzenesulfonyl)-4-methylpiperazine, 1-[(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl)sulfonyl]-4-methylpiperazine, 1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]sulfonyl-4-methylpiperazine, 1-((4-(3-chloro-5-(trifluoromethyl)-2-pyridinyl)oxy)phenyl)sulfonyl)-4-methylpiperazine
| Molecular Formula | C17H17ClF3N3O3S |
|---|---|
| Molecular Weight | 435.06 g/mol |
| LogP | 3.4822 |
| Topological Polar Surface Area | 62.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 435.0631 |
| Heavy Atoms | 28 |
| Complexity | 944.35535 |
Chemical Identifiers
| CAS Number | 344277-97-0 |
|---|---|
| SMILES | CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OC3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
7J-005 (CAS 344277-97-0), with molecular formula C17H17ClF3N3O3S and molecular weight 435.06 g/mol. IUPAC: 1-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]sulfonyl-4-methylpiperazine.
Chemical Property Profile of 7J-005
Property Insights of 7J-005
The XLogP value of 3.4822 indicates that 7J-005 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-005. Following Lipinski's Rule of Five, 7J-005 has 0 hydrogen bond donor(s) and 5 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 7J-005?
The CAS number of 7J-005 is 344277-97-0.
What is the molecular formula of 7J-005?
The molecular formula of 7J-005 is C17H17ClF3N3O3S.
What is the molecular weight of 7J-005?
The molecular weight of 7J-005 is 435.06 g/mol.
Where can I buy 7J-005?
You can request a quote for 7J-005 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7J-005?
Yes, KEHONG BIO provides custom synthesis services for 7J-005 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.