2J-958
TL;DR: 2J-958 (CAS 338773-06-1) is a chemical compound with molecular formula C23H18Cl2F6N4O2S and molecular weight 598.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]-5-(trifluoromethyl)phenyl]benzenesulfonamide
Also Known As: 2J-958, 4-chloro-N-[2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-5-(trifluoromethyl)phenyl]benzenesulfonamide, 4-chloro-N-(2-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}-5-(trifluoromethyl)phenyl)benzene-1-sulfonamide, 4-chloro-N-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-5-(trifluoromethyl)phenyl]benzenesulfonamide
| Molecular Formula | C23H18Cl2F6N4O2S |
|---|---|
| Molecular Weight | 598.04 g/mol |
| LogP | 6.5534 |
| Topological Polar Surface Area | 65.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 598.04315 |
| Heavy Atoms | 38 |
| Complexity | 1425.3009 |
Chemical Identifiers
| CAS Number | 338773-06-1 |
|---|---|
| SMILES | C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)NS(=O)(=O)C3=CC=C(C=C3)Cl)C4=C(C=C(C=N4)C(F)(F)F)Cl |
Product Overview
2J-958 (CAS 338773-06-1), with molecular formula C23H18Cl2F6N4O2S and molecular weight 598.04 g/mol. IUPAC: 4-chloro-N-[2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]-5-(trifluoromethyl)phenyl]benzenesulfonamide.
Chemical Property Profile of 2J-958
Property Insights of 2J-958
The XLogP value of 6.5534 indicates that 2J-958 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 2J-958. Following Lipinski's Rule of Five, 2J-958 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 2J-958?
The CAS number of 2J-958 is 338773-06-1.
What is the molecular formula of 2J-958?
The molecular formula of 2J-958 is C23H18Cl2F6N4O2S.
What is the molecular weight of 2J-958?
The molecular weight of 2J-958 is 598.04 g/mol.
Where can I buy 2J-958?
You can request a quote for 2J-958 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2J-958?
Yes, KEHONG BIO provides custom synthesis services for 2J-958 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.