![2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid structure](/static/products/899/899407-42-2.png)
2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid
TL;DR: 2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid (CAS 899407-42-2) is a chemical compound with molecular formula C18H11ClN2O3S and molecular weight 370.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(4-chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid
Also Known As: [2-(4-Chloro-phenyl)-benzo[4,5]furo[3,2-d]pyrimidin-4-ylsulfanyl]-acetic acid|2-[[2-(4-chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid|2-((2-(4-chlorophenyl)benzofuro[3,2-d]pyrimidin-4-yl)thio)acetic acid|2-[[2-(4-chlorophenyl)-4-benzofuro[3,2-d]pyrimidinyl]thio]acetic acid|2-[[2-(4-chlorophenyl)benzofuro[3,2-d]pyrimidin-4-yl]thio]acetic acid|{[2-(4-chlorophenyl)[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl}acetic acid|2-[[2-(4-chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]ethanoic acid|MLS000551760|SMR000145685|MLS002584100|cid_1948690
| Molecular Formula | C18H11ClN2O3S |
|---|---|
| Molecular Weight | 370.02 g/mol |
| LogP | 4.8731 |
| Topological Polar Surface Area | 76.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 370.01788 |
| Heavy Atoms | 25 |
| Complexity | 1092.8278 |
Chemical Identifiers
| CAS Number | 899407-42-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C(O2)C(=NC(=N3)C4=CC=C(C=C4)Cl)SCC(=O)O |
Product Overview
2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid (CAS 899407-42-2), with molecular formula C18H11ClN2O3S and molecular weight 370.02 g/mol. IUPAC: 2-[[2-(4-chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid.
Chemical Property Profile of 2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid
Property Insights of 2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid
The XLogP value of 4.8731 indicates that 2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid. Following Lipinski's Rule of Five, 2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid has 1 hydrogen bond donor(s) and 5 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 2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid?
The CAS number of 2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid is 899407-42-2.
What is the molecular formula of 2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid?
The molecular formula of 2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid is C18H11ClN2O3S.
What is the molecular weight of 2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid?
The molecular weight of 2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid is 370.02 g/mol.
Where can I buy 2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid?
You can request a quote for 2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[[2-(4-Chlorophenyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]sulfanyl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.