![Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate structure](/static/products/844/844654-33-7.png)
Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate
TL;DR: Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate (CAS 844654-33-7) is a chemical compound with molecular formula C14H16N2O4S and molecular weight 308.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(7,8-dimethoxyphthalazin-1-yl)sulfanylacetate
Also Known As: ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate, ethyl 2-((7,8-dimethoxyphthalazin-1-yl)thio)acetate, ethyl 2-(7,8-dimethoxyphthalazin-1-yl)sulfanylacetate
| Molecular Formula | C14H16N2O4S |
|---|---|
| Molecular Weight | 308.08 g/mol |
| LogP | 2.3022 |
| Topological Polar Surface Area | 70.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 308.08307 |
| Heavy Atoms | 21 |
| Complexity | 648.1518 |
Chemical Identifiers
| CAS Number | 844654-33-7 |
|---|---|
| SMILES | CCOC(=O)CSC1=C2C(=CN=N1)C=CC(=C2OC)OC |
Product Overview
Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate (CAS 844654-33-7), with molecular formula C14H16N2O4S and molecular weight 308.08 g/mol. IUPAC: ethyl 2-(7,8-dimethoxyphthalazin-1-yl)sulfanylacetate.
Chemical Property Profile of Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate
Property Insights of Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate
The XLogP value of 2.3022 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate. The TPSA of 70.54 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate. Following Lipinski's Rule of Five, Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate has 0 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 Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate?
The CAS number of Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate is 844654-33-7.
What is the molecular formula of Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate?
The molecular formula of Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate is C14H16N2O4S.
What is the molecular weight of Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate?
The molecular weight of Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate is 308.08 g/mol.
Where can I buy Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate?
You can request a quote for Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl [(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.