尿嘧啶-4-乙酸
TL;DR: 尿嘧啶-4-乙酸 (CAS 4628-39-1) is a chemical compound with molecular formula C6H6N2O4 and molecular weight 170.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
尿嘧啶-4-乙酸
2-(2,4-dioxo-1H-pyrimidin-6-yl)acetic acid
Also Known As: 6-Carboxymethyluracil, Uracil-4-acetic acid, URACIL-6-ACETIC ACID, uracil-6-ylacetic acid, Uracil-4acetic acid
| Molecular Formula | C6H6N2O4 |
|---|---|
| Molecular Weight | 170.03 g/mol |
| LogP | -1.7 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.03276 |
| Heavy Atoms | 12 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 4628-39-1 |
|---|---|
| SMILES | C1=C(NC(=O)NC1=O)CC(=O)O |
| InChIKey | NQAUNZZEYKWTHM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
尿嘧啶-4-乙酸 (CAS 4628-39-1), with molecular formula C6H6N2O4 and molecular weight 170.03 g/mol. IUPAC: 2-(2,4-dioxo-1H-pyrimidin-6-yl)acetic acid.
Chemical Property Profile of 尿嘧啶-4-乙酸
Property Insights of 尿嘧啶-4-乙酸
The XLogP value of -1.7 indicates that 尿嘧啶-4-乙酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 尿嘧啶-4-乙酸. Following Lipinski's Rule of Five, 尿嘧啶-4-乙酸 has 3 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 尿嘧啶-4-乙酸?
The CAS number of 尿嘧啶-4-乙酸 is 4628-39-1.
What is the molecular formula of 尿嘧啶-4-乙酸?
The molecular formula of 尿嘧啶-4-乙酸 is C6H6N2O4.
What is the molecular weight of 尿嘧啶-4-乙酸?
The molecular weight of 尿嘧啶-4-乙酸 is 170.03 g/mol.
Where can I buy 尿嘧啶-4-乙酸?
You can request a quote for 尿嘧啶-4-乙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 尿嘧啶-4-乙酸?
Yes, KEHONG BIO provides custom synthesis services for 尿嘧啶-4-乙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.