![Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate structure](/static/products/851/851130-57-9.png)
Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate
TL;DR: Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate (CAS 851130-57-9) is a chemical compound with molecular formula C19H14N2O3S and molecular weight 350.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)acetate
Also Known As: ChemDiv3_008683, IDI1_026593, benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate, AB00420290-04, benzyl 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)acetate
| Molecular Formula | C19H14N2O3S |
|---|---|
| Molecular Weight | 350.07 g/mol |
| LogP | 4.2115 |
| Topological Polar Surface Area | 65.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 350.0725 |
| Heavy Atoms | 25 |
| Complexity | 1030.6514 |
Chemical Identifiers
| CAS Number | 851130-57-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)CSC2=NC=NC3=C2OC4=CC=CC=C43 |
Product Overview
Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate (CAS 851130-57-9), with molecular formula C19H14N2O3S and molecular weight 350.07 g/mol. IUPAC: benzyl 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)acetate.
Chemical Property Profile of Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate
Property Insights of Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate
The XLogP value of 4.2115 indicates that Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate 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 Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate. Following Lipinski's Rule of Five, Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate 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 Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate?
The CAS number of Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate is 851130-57-9.
What is the molecular formula of Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate?
The molecular formula of Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate is C19H14N2O3S.
What is the molecular weight of Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate?
The molecular weight of Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate is 350.07 g/mol.
Where can I buy Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate?
You can request a quote for Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.