![Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate structure](/static/products/851/851130-55-7.png)
Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate
TL;DR: Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate (CAS 851130-55-7) is a chemical compound with molecular formula C15H14N2O3S and molecular weight 302.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)propanoate
Also Known As: ChemDiv3_008639, IDI1_026549, ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate, F0596-0094, ethyl 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)propanoate
| Molecular Formula | C15H14N2O3S |
|---|---|
| Molecular Weight | 302.07 g/mol |
| LogP | 3.4197 |
| Topological Polar Surface Area | 65.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.0725 |
| Heavy Atoms | 21 |
| Complexity | 799.8189 |
Chemical Identifiers
| CAS Number | 851130-55-7 |
|---|---|
| SMILES | CCOC(=O)C(C)SC1=NC=NC2=C1OC3=CC=CC=C32 |
Product Overview
Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate (CAS 851130-55-7), with molecular formula C15H14N2O3S and molecular weight 302.07 g/mol. IUPAC: ethyl 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)propanoate.
Chemical Property Profile of Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate
Property Insights of Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate
The XLogP value of 3.4197 indicates that Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate. Following Lipinski's Rule of Five, Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate has 0 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 Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate?
The CAS number of Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate is 851130-55-7.
What is the molecular formula of Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate?
The molecular formula of Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate is C15H14N2O3S.
What is the molecular weight of Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate?
The molecular weight of Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate is 302.07 g/mol.
Where can I buy Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate?
You can request a quote for Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.