2J-941
TL;DR: 2J-941 (CAS 338772-81-9) is a chemical compound with molecular formula C20H17Cl2F3N4O2S and molecular weight 504.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[2-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethylamino]phenyl]benzenesulfonamide
Also Known As: 2J-941, 4-chloro-N-[2-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethylamino]phenyl]benzenesulfonamide, 4-chloro-N-{2-[(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)amino]phenyl}benzenesulfonamide, 4-chloro-N-{2-[(2-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}ethyl)amino]phenyl}benzene-1-sulfonamide
| Molecular Formula | C20H17Cl2F3N4O2S |
|---|---|
| Molecular Weight | 504.04 g/mol |
| LogP | 5.732 |
| Topological Polar Surface Area | 83.12 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 504.04013 |
| Heavy Atoms | 32 |
| Complexity | 1190.1945 |
Chemical Identifiers
| CAS Number | 338772-81-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NCCNC2=C(C=C(C=N2)C(F)(F)F)Cl)NS(=O)(=O)C3=CC=C(C=C3)Cl |
Product Overview
2J-941 (CAS 338772-81-9), with molecular formula C20H17Cl2F3N4O2S and molecular weight 504.04 g/mol. IUPAC: 4-chloro-N-[2-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethylamino]phenyl]benzenesulfonamide.
Chemical Property Profile of 2J-941
Property Insights of 2J-941
The XLogP value of 5.732 indicates that 2J-941 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 2J-941. Following Lipinski's Rule of Five, 2J-941 has 3 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-941?
The CAS number of 2J-941 is 338772-81-9.
What is the molecular formula of 2J-941?
The molecular formula of 2J-941 is C20H17Cl2F3N4O2S.
What is the molecular weight of 2J-941?
The molecular weight of 2J-941 is 504.04 g/mol.
Where can I buy 2J-941?
You can request a quote for 2J-941 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2J-941?
Yes, KEHONG BIO provides custom synthesis services for 2J-941 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.