BAS 06900099
TL;DR: BAS 06900099 (CAS 445266-27-3) is a chemical compound with molecular formula C21H18FN3OS2 and molecular weight 411.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-cyano-4-(4-fluorophenyl)-6-thiophen-2-yl-2-pyridinyl]sulfanyl]-N-propan-2-ylacetamide
Also Known As: BAS 06900099, 2-[3-cyano-4-(4-fluorophenyl)-6-thiophen-2-ylpyridin-2-yl]sulfanyl-N-propan-2-ylacetamide, AM-807/12740330, 2-{[3-cyano-4-(4-fluorophenyl)-6-(2-thienyl)-2-pyridinyl]sulfanyl}-N-isopropylacetamide, 2-((3-cyano-4-(4-fluorophenyl)-6-(thiophen-2-yl)pyridin-2-yl)thio)-N-isopropylacetamide
| Molecular Formula | C21H18FN3OS2 |
|---|---|
| Molecular Weight | 411.09 g/mol |
| LogP | 5.10458 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 411.08752 |
| Heavy Atoms | 28 |
| Complexity | 1009.3751 |
Chemical Identifiers
| CAS Number | 445266-27-3 |
|---|---|
| SMILES | CC(C)NC(=O)CSC1=C(C(=CC(=N1)C2=CC=CS2)C3=CC=C(C=C3)F)C#N |
Product Overview
BAS 06900099 (CAS 445266-27-3), with molecular formula C21H18FN3OS2 and molecular weight 411.09 g/mol. IUPAC: 2-[[3-cyano-4-(4-fluorophenyl)-6-thiophen-2-yl-2-pyridinyl]sulfanyl]-N-propan-2-ylacetamide.
Chemical Property Profile of BAS 06900099
Property Insights of BAS 06900099
The XLogP value of 5.10458 indicates that BAS 06900099 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 06900099. Following Lipinski's Rule of Five, BAS 06900099 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 06900099?
The CAS number of BAS 06900099 is 445266-27-3.
What is the molecular formula of BAS 06900099?
The molecular formula of BAS 06900099 is C21H18FN3OS2.
What is the molecular weight of BAS 06900099?
The molecular weight of BAS 06900099 is 411.09 g/mol.
Where can I buy BAS 06900099?
You can request a quote for BAS 06900099 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06900099?
Yes, KEHONG BIO provides custom synthesis services for BAS 06900099 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.