2K-054
TL;DR: 2K-054 (CAS 338773-45-8) is a chemical compound with molecular formula C18H11ClF4N2O2S2 and molecular weight 461.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]phenyl]-4-fluorobenzenesulfonamide
Also Known As: 2K-054, N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}phenyl)-4-fluorobenzenesulfonamide, N-(2-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl}phenyl)-4-fluorobenzene-1-sulfonamide, N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanylphenyl]-4-fluorobenzenesulfonamide, N-(2-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl}phenyl)-4-fluorobenzenesulfonamide
| Molecular Formula | C18H11ClF4N2O2S2 |
|---|---|
| Molecular Weight | 461.99 g/mol |
| LogP | 5.8449 |
| Topological Polar Surface Area | 59.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 461.98865 |
| Heavy Atoms | 29 |
| Complexity | 1137.3433 |
Chemical Identifiers
| CAS Number | 338773-45-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NS(=O)(=O)C2=CC=C(C=C2)F)SC3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
2K-054 (CAS 338773-45-8), with molecular formula C18H11ClF4N2O2S2 and molecular weight 461.99 g/mol. IUPAC: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]phenyl]-4-fluorobenzenesulfonamide.
Chemical Property Profile of 2K-054
Property Insights of 2K-054
The XLogP value of 5.8449 indicates that 2K-054 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.06 Ų, 2K-054 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2K-054 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2K-054?
The CAS number of 2K-054 is 338773-45-8.
What is the molecular formula of 2K-054?
The molecular formula of 2K-054 is C18H11ClF4N2O2S2.
What is the molecular weight of 2K-054?
The molecular weight of 2K-054 is 461.99 g/mol.
Where can I buy 2K-054?
You can request a quote for 2K-054 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2K-054?
Yes, KEHONG BIO provides custom synthesis services for 2K-054 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.