A0185/0008214
TL;DR: A0185/0008214 (CAS 339156-89-7) is a chemical compound with molecular formula C17H11F6N3OS and molecular weight 419.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridinyl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
Also Known As: A0185/0008214, 2-{[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide, 2-((3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl)thio)-N-(3-(trifluoromethyl)phenyl)acetamide, 2-[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide, 2-{[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridinyl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
| Molecular Formula | C17H11F6N3OS |
|---|---|
| Molecular Weight | 419.05 g/mol |
| LogP | 5.0301 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 419.0527 |
| Heavy Atoms | 28 |
| Complexity | 933.9558 |
Chemical Identifiers
| CAS Number | 339156-89-7 |
|---|---|
| SMILES | CC1=CC(=NC(=C1C#N)SCC(=O)NC2=CC=CC(=C2)C(F)(F)F)C(F)(F)F |
Product Overview
A0185/0008214 (CAS 339156-89-7), with molecular formula C17H11F6N3OS and molecular weight 419.05 g/mol. IUPAC: 2-[[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridinyl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide.
Chemical Property Profile of A0185/0008214
Property Insights of A0185/0008214
The XLogP value of 5.0301 indicates that A0185/0008214 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for A0185/0008214. Following Lipinski's Rule of Five, A0185/0008214 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 A0185/0008214?
The CAS number of A0185/0008214 is 339156-89-7.
What is the molecular formula of A0185/0008214?
The molecular formula of A0185/0008214 is C17H11F6N3OS.
What is the molecular weight of A0185/0008214?
The molecular weight of A0185/0008214 is 419.05 g/mol.
Where can I buy A0185/0008214?
You can request a quote for A0185/0008214 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A0185/0008214?
Yes, KEHONG BIO provides custom synthesis services for A0185/0008214 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.