BAS 00865702
TL;DR: BAS 00865702 (CAS 264255-00-7) is a chemical compound with molecular formula C16H16N2O4S and molecular weight 332.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[5-cyano-4-(4-hydroxyphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetate
Also Known As: BAS 00865702, ethyl {[3-cyano-4-(4-hydroxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate, ethyl 2-((3-cyano-4-(4-hydroxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl)thio)acetate, ethyl 2-[[5-cyano-4-(4-hydroxyphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetate, ETHYL 2-{[3-CYANO-4-(4-HYDROXYPHENYL)-6-OXO-4,5-DIHYDRO-1H-PYRIDIN-2-YL]SULFANYL}ACETATE
| Molecular Formula | C16H16N2O4S |
|---|---|
| Molecular Weight | 332.08 g/mol |
| LogP | 2.02718 |
| Topological Polar Surface Area | 99.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 332.08307 |
| Heavy Atoms | 23 |
| Complexity | 676.3158 |
Chemical Identifiers
| CAS Number | 264255-00-7 |
|---|---|
| SMILES | CCOC(=O)CSC1=C(C(CC(=O)N1)C2=CC=C(C=C2)O)C#N |
Product Overview
BAS 00865702 (CAS 264255-00-7), with molecular formula C16H16N2O4S and molecular weight 332.08 g/mol. IUPAC: ethyl 2-[[5-cyano-4-(4-hydroxyphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetate.
Chemical Property Profile of BAS 00865702
Property Insights of BAS 00865702
The XLogP value of 2.02718 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00865702. The TPSA of 99.42 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00865702. Following Lipinski's Rule of Five, BAS 00865702 has 2 hydrogen bond donor(s) and 6 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 00865702?
The CAS number of BAS 00865702 is 264255-00-7.
What is the molecular formula of BAS 00865702?
The molecular formula of BAS 00865702 is C16H16N2O4S.
What is the molecular weight of BAS 00865702?
The molecular weight of BAS 00865702 is 332.08 g/mol.
Where can I buy BAS 00865702?
You can request a quote for BAS 00865702 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00865702?
Yes, KEHONG BIO provides custom synthesis services for BAS 00865702 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.