![4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid structure](/static/products/2576/257613-44-8.webp)
4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid
TL;DR: 4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid (CAS 257613-44-8) is a chemical compound with molecular formula C12H8N2O4 and molecular weight 244.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetic acid
Also Known As: (4-oxo[1]benzofuro[3,2-d]pyrimidin-3(4H)-yl)acetic acid, 4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid, 2-{6-oxo-8-oxa-3,5-diazatricyclo[7.4.0.0,2,7]trideca-1(13),2(7),3,9,11-pentaen-5-yl}acetic acid, 2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetic acid, 4-Oxobenzofuro(3,2-d)pyrimidine-3(4H)-acetic acid
| Molecular Formula | C12H8N2O4 |
|---|---|
| Molecular Weight | 244.05 g/mol |
| LogP | 1.2273 |
| Topological Polar Surface Area | 85.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 244.0484 |
| Heavy Atoms | 18 |
| Complexity | 815.662 |
Chemical Identifiers
| CAS Number | 257613-44-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C(O2)C(=O)N(C=N3)CC(=O)O |
Product Overview
4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid (CAS 257613-44-8), with molecular formula C12H8N2O4 and molecular weight 244.05 g/mol. IUPAC: 2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetic acid.
Chemical Property Profile of 4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid
Property Insights of 4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid
The XLogP value of 1.2273 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid. The TPSA of 85.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid. Following Lipinski's Rule of Five, 4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid has 1 hydrogen bond donor(s) and 4 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 4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid?
The CAS number of 4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid is 257613-44-8.
What is the molecular formula of 4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid?
The molecular formula of 4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid is C12H8N2O4.
What is the molecular weight of 4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid?
The molecular weight of 4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid is 244.05 g/mol.
Where can I buy 4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid?
You can request a quote for 4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Oxobenzofuro[3,2-d]pyrimidine-3(4H)-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.