BAS 06900319
TL;DR: BAS 06900319 (CAS 445265-83-8) is a chemical compound with molecular formula C21H16F3N3OS2 and molecular weight 447.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)-2-pyridinyl]sulfanyl]-N-(1-phenylethyl)acetamide
Also Known As: BAS 06900319, 2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(1-phenylethyl)acetamide, AM-807/12427314, 2-{[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridinyl]sulfanyl}-N-(1-phenylethyl)acetamide, 2-[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)(2-pyridylthio)]-N-(phenylethyl)ac etamide
| Molecular Formula | C21H16F3N3OS2 |
|---|---|
| Molecular Weight | 447.07 g/mol |
| LogP | 5.67008 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 447.0687 |
| Heavy Atoms | 30 |
| Complexity | 1061.591 |
Chemical Identifiers
| CAS Number | 445265-83-8 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)NC(=O)CSC2=C(C(=CC(=N2)C3=CC=CS3)C(F)(F)F)C#N |
Product Overview
BAS 06900319 (CAS 445265-83-8), with molecular formula C21H16F3N3OS2 and molecular weight 447.07 g/mol. IUPAC: 2-[[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)-2-pyridinyl]sulfanyl]-N-(1-phenylethyl)acetamide.
Chemical Property Profile of BAS 06900319
Property Insights of BAS 06900319
The XLogP value of 5.67008 indicates that BAS 06900319 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 BAS 06900319. Following Lipinski's Rule of Five, BAS 06900319 has 1 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 BAS 06900319?
The CAS number of BAS 06900319 is 445265-83-8.
What is the molecular formula of BAS 06900319?
The molecular formula of BAS 06900319 is C21H16F3N3OS2.
What is the molecular weight of BAS 06900319?
The molecular weight of BAS 06900319 is 447.07 g/mol.
Where can I buy BAS 06900319?
You can request a quote for BAS 06900319 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06900319?
Yes, KEHONG BIO provides custom synthesis services for BAS 06900319 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.