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Tegafur-Uracil structure
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Tegafur-Uracil

TL;DR: Tegafur-Uracil (CAS 74578-38-4) is a chemical compound with molecular formula C12H13FN4O5 and molecular weight 312.087 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-fluoro-1-(oxolan-2-yl)pyrimidine-2,4-dione;1H-pyrimidine-2,4-dione

Also Known As: Tegafur-Uracil, Uftoral, Ufur, 1-Uft protocol, Youfuding

CAS Number
74578-38-4
Molecular Formula
C12H13FN4O5
Molecular Weight
312.087 g/mol
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Application Areas

Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (1 patents) Analytical Reagents (1 patents) Biotechnology (10 patents) Heterocyclic Building Blocks (4 patents) Organic Building Blocks (1 patents)

Technical Specifications

Molecular FormulaC12H13FN4O5
Molecular Weight312.087 g/mol
XLogP-0.95
Topological Polar Surface Area (TPSA)117.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors6
Rotatable Bonds1
Exact Mass312.087 Da
Heavy Atoms22
Complexity477.0
SMILESC1CC(OC1)N2C=C(C(=O)NC2=O)F.C1=CNC(=O)NC1=O
InChIKeyDHMYGZIEILLVNR-UHFFFAOYSA-N

Chemical Property Profile of Tegafur-Uracil

XLogP
-0.95
TPSA (Topological Polar Surface Area)
117.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
6
Rotatable Bonds
1
Heavy Atoms
22
Complexity
477.0
Exact Mass
312.087
Monoisotopic Mass
312.087
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Tegafur-Uracil

The XLogP value of -0.95 indicates that Tegafur-Uracil is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Tegafur-Uracil. Following Lipinski's Rule of Five, Tegafur-Uracil has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Tegafur-Uracil?

The CAS number of Tegafur-Uracil is 74578-38-4.

What is the molecular formula of Tegafur-Uracil?

The molecular formula of Tegafur-Uracil is C12H13FN4O5.

What is the molecular weight of Tegafur-Uracil?

The molecular weight of Tegafur-Uracil is 312.087 g/mol.

Where can I buy Tegafur-Uracil?

You can request a quote for Tegafur-Uracil directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Tegafur-Uracil?

Yes, CoreyChem provides custom synthesis services for Tegafur-Uracil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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