9G-354S
TL;DR: 9G-354S (CAS 339104-86-8) is a chemical compound with molecular formula C21H15ClF3NO3S2 and molecular weight 485.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-4-methylsulfonyl-N-[4-[3-(trifluoromethyl)phenyl]sulfanylphenyl]benzamide
Also Known As: 9G-354S, 2-chloro-4-(methylsulfonyl)-N-(4-{[3-(trifluoromethyl)phenyl]sulfanyl}phenyl)benzenecarboxamide, 2-chloro-4-methanesulfonyl-N-(4-{[3-(trifluoromethyl)phenyl]sulfanyl}phenyl)benzamide, 2-chloro-4-methylsulfonyl-N-[4-[3-(trifluoromethyl)phenyl]sulfanylphenyl]benzamide
| Molecular Formula | C21H15ClF3NO3S2 |
|---|---|
| Molecular Weight | 485.01 g/mol |
| LogP | 6.1658 |
| Topological Polar Surface Area | 63.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 485.0134 |
| Heavy Atoms | 31 |
| Complexity | 1227.3625 |
Chemical Identifiers
| CAS Number | 339104-86-8 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC(=C(C=C1)C(=O)NC2=CC=C(C=C2)SC3=CC=CC(=C3)C(F)(F)F)Cl |
Product Overview
9G-354S (CAS 339104-86-8), with molecular formula C21H15ClF3NO3S2 and molecular weight 485.01 g/mol. IUPAC: 2-chloro-4-methylsulfonyl-N-[4-[3-(trifluoromethyl)phenyl]sulfanylphenyl]benzamide.
Chemical Property Profile of 9G-354S
Property Insights of 9G-354S
The XLogP value of 6.1658 indicates that 9G-354S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 9G-354S. Following Lipinski's Rule of Five, 9G-354S 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 9G-354S?
The CAS number of 9G-354S is 339104-86-8.
What is the molecular formula of 9G-354S?
The molecular formula of 9G-354S is C21H15ClF3NO3S2.
What is the molecular weight of 9G-354S?
The molecular weight of 9G-354S is 485.01 g/mol.
Where can I buy 9G-354S?
You can request a quote for 9G-354S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9G-354S?
Yes, KEHONG BIO provides custom synthesis services for 9G-354S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.