5-Fluoro-1,3-dimethyluracil
TL;DR: 5-Fluoro-1,3-dimethyluracil (CAS 3013-92-1) is a chemical compound with molecular formula C6H7FN2O2 and molecular weight 158.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-fluoro-1,3-dimethylpyrimidine-2,4-dione
Also Known As: 5-Fluoro-1,3-dimethyluracil, Fluorouracil Impurity 34, 1,3-Dimethyl-5-fluorouracil, 5-fluoro-1,3-dimethylpyrimidine-2,4(1H,3H)-dione, 5-fluoro-1,3-dimethylpyrimidine-2,4-dione
| Molecular Formula | C6H7FN2O2 |
|---|---|
| Molecular Weight | 158.05 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 158.04915 |
| Heavy Atoms | 11 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 3013-92-1 |
|---|---|
| SMILES | CN1C=C(C(=O)N(C1=O)C)F |
| InChIKey | DDEWVRFHURYTHA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Fluoro-1,3-dimethyluracil (CAS 3013-92-1), with molecular formula C6H7FN2O2 and molecular weight 158.05 g/mol. IUPAC: 5-fluoro-1,3-dimethylpyrimidine-2,4-dione.
Chemical Property Profile of 5-Fluoro-1,3-dimethyluracil
Property Insights of 5-Fluoro-1,3-dimethyluracil
The XLogP value of -0.3 indicates that 5-Fluoro-1,3-dimethyluracil is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.6 Ų, 5-Fluoro-1,3-dimethyluracil exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Fluoro-1,3-dimethyluracil has 0 hydrogen bond donor(s) and 3 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 5-Fluoro-1,3-dimethyluracil?
The CAS number of 5-Fluoro-1,3-dimethyluracil is 3013-92-1.
What is the molecular formula of 5-Fluoro-1,3-dimethyluracil?
The molecular formula of 5-Fluoro-1,3-dimethyluracil is C6H7FN2O2.
What is the molecular weight of 5-Fluoro-1,3-dimethyluracil?
The molecular weight of 5-Fluoro-1,3-dimethyluracil is 158.05 g/mol.
Where can I buy 5-Fluoro-1,3-dimethyluracil?
You can request a quote for 5-Fluoro-1,3-dimethyluracil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Fluoro-1,3-dimethyluracil?
Yes, KEHONG BIO provides custom synthesis services for 5-Fluoro-1,3-dimethyluracil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.