BAS 02589781
TL;DR: BAS 02589781 (CAS 361980-41-8) is a chemical compound with molecular formula C19H18N4O3S2 and molecular weight 414.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-cyano-4-(2-ethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(1,3-thiazol-2-yl)acetamide
Also Known As: BAS 02589781, 2-((3-cyano-4-(2-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl)thio)-N-(thiazol-2-yl)acetamide, 2-{[3-cyano-4-(2-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide, 2-[[5-cyano-4-(2-ethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(1,3-thiazol-2-yl)acetamide, 2-[3-Cyano-4-(2-ethoxy-phenyl)-6-oxo-1,4,5,6-tetrahydro-pyridin-2-ylsulfanyl]-N-thiazol-2-yl-acetamide
| Molecular Formula | C19H18N4O3S2 |
|---|---|
| Molecular Weight | 414.08 g/mol |
| LogP | 3.25238 |
| Topological Polar Surface Area | 104.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 414.08203 |
| Heavy Atoms | 28 |
| Complexity | 934.9054 |
Chemical Identifiers
| CAS Number | 361980-41-8 |
|---|---|
| SMILES | CCOC1=CC=CC=C1C2CC(=O)NC(=C2C#N)SCC(=O)NC3=NC=CS3 |
Product Overview
BAS 02589781 (CAS 361980-41-8), with molecular formula C19H18N4O3S2 and molecular weight 414.08 g/mol. IUPAC: 2-[[5-cyano-4-(2-ethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(1,3-thiazol-2-yl)acetamide.
Chemical Property Profile of BAS 02589781
Property Insights of BAS 02589781
The XLogP value of 3.25238 indicates that BAS 02589781 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.11 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02589781. Following Lipinski's Rule of Five, BAS 02589781 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02589781?
The CAS number of BAS 02589781 is 361980-41-8.
What is the molecular formula of BAS 02589781?
The molecular formula of BAS 02589781 is C19H18N4O3S2.
What is the molecular weight of BAS 02589781?
The molecular weight of BAS 02589781 is 414.08 g/mol.
Where can I buy BAS 02589781?
You can request a quote for BAS 02589781 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02589781?
Yes, KEHONG BIO provides custom synthesis services for BAS 02589781 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.