8J-026
TL;DR: 8J-026 (CAS 339099-67-1) is a chemical compound with molecular formula C24H19Cl2F6N5O2 and molecular weight 593.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-[5-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazine-1-carbonyl]-1H-pyrrol-3-yl]propan-1-one
Also Known As: 8J-026, 2-(3-Chloro-5-(trifluoromethyl)-2-pyridinyl)-1-(5-((4-(3-chloro-5-(trifluoromethyl)-2-pyridinyl)piperazino)carbonyl)-1h-pyrrol-3-yl)-1-propanone, 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1-(5-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carbonyl}-1H-pyrrol-3-yl)propan-1-one, 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1-[5-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carbonyl]-1H-pyrrol-3-yl]propan-1-one, 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-[5-({4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}carbonyl)-1H-pyrrol-3-yl]-1-propanone
| Molecular Formula | C24H19Cl2F6N5O2 |
|---|---|
| Molecular Weight | 593.08 g/mol |
| LogP | 6.0979 |
| Topological Polar Surface Area | 82.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 593.082 |
| Heavy Atoms | 39 |
| Complexity | 1400.3778 |
Chemical Identifiers
| CAS Number | 339099-67-1 |
|---|---|
| SMILES | CC(C1=C(C=C(C=N1)C(F)(F)F)Cl)C(=O)C2=CNC(=C2)C(=O)N3CCN(CC3)C4=C(C=C(C=N4)C(F)(F)F)Cl |
Product Overview
8J-026 (CAS 339099-67-1), with molecular formula C24H19Cl2F6N5O2 and molecular weight 593.08 g/mol. IUPAC: 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-[5-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazine-1-carbonyl]-1H-pyrrol-3-yl]propan-1-one.
Chemical Property Profile of 8J-026
Property Insights of 8J-026
The XLogP value of 6.0979 indicates that 8J-026 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 8J-026. Following Lipinski's Rule of Five, 8J-026 has 1 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 8J-026?
The CAS number of 8J-026 is 339099-67-1.
What is the molecular formula of 8J-026?
The molecular formula of 8J-026 is C24H19Cl2F6N5O2.
What is the molecular weight of 8J-026?
The molecular weight of 8J-026 is 593.08 g/mol.
Where can I buy 8J-026?
You can request a quote for 8J-026 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8J-026?
Yes, KEHONG BIO provides custom synthesis services for 8J-026 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.