![Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate structure](/static/products/5610/561008-73-9.webp)
Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate
TL;DR: Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate (CAS 561008-73-9) is a chemical compound with molecular formula C19H17FN2O6S and molecular weight 420.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(2-fluorophenoxy)acetyl]oxymethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate
Also Known As: Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate, ethyl 2-[[2-(2-fluorophenoxy)acetyl]oxymethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate
| Molecular Formula | C19H17FN2O6S |
|---|---|
| Molecular Weight | 420.08 g/mol |
| LogP | 2.73102 |
| Topological Polar Surface Area | 107.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 420.07913 |
| Heavy Atoms | 29 |
| Complexity | 1123.5751 |
Chemical Identifiers
| CAS Number | 561008-73-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)COC(=O)COC3=CC=CC=C3F)C |
Product Overview
Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate (CAS 561008-73-9), with molecular formula C19H17FN2O6S and molecular weight 420.08 g/mol. IUPAC: ethyl 2-[[2-(2-fluorophenoxy)acetyl]oxymethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate.
Chemical Property Profile of Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate
Property Insights of Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate
The XLogP value of 2.73102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate. The TPSA of 107.58 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate has 1 hydrogen bond donor(s) and 8 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 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate?
The CAS number of Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate is 561008-73-9.
What is the molecular formula of Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate?
The molecular formula of Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate is C19H17FN2O6S.
What is the molecular weight of Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate?
The molecular weight of Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate is 420.08 g/mol.
Where can I buy Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate?
You can request a quote for Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[[[2-(2-fluorophenoxy)acetyl]oxy]methyl]-1,4-dihydro-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.