![[(8-Chloro-2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid structure](/static/products/900/900281-39-2.png)
[(8-Chloro-2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid
TL;DR: [(8-Chloro-2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid (CAS 900281-39-2) is a chemical compound with molecular formula C13H9ClN2O3S and molecular weight 308.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(8-chloro-2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid
Also Known As: [(8-chloro-2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid|2-((8-chloro-2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetic acid|2-[(8-chloro-2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid
| Molecular Formula | C13H9ClN2O3S |
|---|---|
| Molecular Weight | 308.00 g/mol |
| LogP | 3.51452 |
| Topological Polar Surface Area | 76.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.00223 |
| Heavy Atoms | 20 |
| Complexity | 831.20087 |
Chemical Identifiers
| CAS Number | 900281-39-2 |
|---|---|
| SMILES | CC1=NC2=C(C(=N1)SCC(=O)O)OC3=C2C=C(C=C3)Cl |
Product Overview
[(8-Chloro-2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid (CAS 900281-39-2), with molecular formula C13H9ClN2O3S and molecular weight 308.00 g/mol. IUPAC: 2-[(8-chloro-2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid.
Chemical Property Profile of [(8-Chloro-2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid
Property Insights of [(8-Chloro-2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid
The XLogP value of 3.51452 indicates that [(8-Chloro-2-methyl[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 [(8-Chloro-2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid. Following Lipinski's Rule of Five, [(8-Chloro-2-methyl[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 [(8-Chloro-2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid?
The CAS number of [(8-Chloro-2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid is 900281-39-2.
What is the molecular formula of [(8-Chloro-2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid?
The molecular formula of [(8-Chloro-2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid is C13H9ClN2O3S.
What is the molecular weight of [(8-Chloro-2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid?
The molecular weight of [(8-Chloro-2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid is 308.00 g/mol.
Where can I buy [(8-Chloro-2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid?
You can request a quote for [(8-Chloro-2-methyl[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 [(8-Chloro-2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [(8-Chloro-2-methyl[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.