5K-623S
TL;DR: 5K-623S (CAS 338957-63-4) is a chemical compound with molecular formula C18H12ClF3N2OS2 and molecular weight 428.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-[3-(trifluoromethyl)phenyl]sulfanylacetamide
Also Known As: 5K-623S, N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-{[3-(trifluoromethyl)phenyl]sulfanyl}acetamide, N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-[3-(trifluoromethyl)phenyl]sulfanylacetamide, N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-[3-(trifluoromethyl)phenyl]sulfanyl-acetamide
| Molecular Formula | C18H12ClF3N2OS2 |
|---|---|
| Molecular Weight | 428.00 g/mol |
| LogP | 6.2131 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 428.00317 |
| Heavy Atoms | 27 |
| Complexity | 942.27985 |
Chemical Identifiers
| CAS Number | 338957-63-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)SCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Cl)C(F)(F)F |
Product Overview
5K-623S (CAS 338957-63-4), with molecular formula C18H12ClF3N2OS2 and molecular weight 428.00 g/mol. IUPAC: N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-[3-(trifluoromethyl)phenyl]sulfanylacetamide.
Chemical Property Profile of 5K-623S
Property Insights of 5K-623S
The XLogP value of 6.2131 indicates that 5K-623S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, 5K-623S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5K-623S 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 5K-623S?
The CAS number of 5K-623S is 338957-63-4.
What is the molecular formula of 5K-623S?
The molecular formula of 5K-623S is C18H12ClF3N2OS2.
What is the molecular weight of 5K-623S?
The molecular weight of 5K-623S is 428.00 g/mol.
Where can I buy 5K-623S?
You can request a quote for 5K-623S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5K-623S?
Yes, KEHONG BIO provides custom synthesis services for 5K-623S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.