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5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione structure
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5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione

TL;DR: 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione (CAS 288102-94-3) is a chemical compound with molecular formula C17H14N2O4 and molecular weight 310.09537 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-methyl-5-(4-phenoxyphenyl)-1,3-diazinane-2,4,6-trione

Also Known As: 1g4k, 5-methyl-5-(4-phenoxy-phenyl)-pyrimidine-2,4,6-trione, 5-methyl-5-(4-phenoxyphenyl)-1,3-diazinane-2,4,6-trione, 5-methyl-5-(4-phenoxyphenyl)barbituric acid, J1.522.389H

CAS Number
288102-94-3
Molecular Formula
C17H14N2O4
Molecular Weight
310.09537 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (4 patents) Pharmaceutical Intermediates (6 patents)

Technical Specifications

Molecular FormulaC17H14N2O4
Molecular Weight310.09537 g/mol
XLogP2.4
Topological Polar Surface Area (TPSA)84.5 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds3
Exact Mass310.09537 Da
Heavy Atoms23
Complexity471.0
SMILESCC1(C(=O)NC(=O)NC1=O)C2=CC=C(C=C2)OC3=CC=CC=C3
InChIKeyRTBMLCLTYAPKIF-UHFFFAOYSA-N

Product Description

Applications: 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione is a pharmaceutical intermediate identified by CAS number 288102-94-3 and the molecular formula C17H14N2O4 and a molecular weight of 310.1 g/mol. Synonyms include 1g4k and 5-methyl-5-(4-phenoxy-phenyl)-pyrimidine-2,4,6-trione.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione

XLogP
2.4
TPSA (Topological Polar Surface Area)
84.5
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
3
Heavy Atoms
23
Complexity
471.0
Exact Mass
310.09537
Monoisotopic Mass
310.09537
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 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione

The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione. Following Lipinski's Rule of Five, 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione?

The CAS number of 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione is 288102-94-3.

What is the molecular formula of 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione?

The molecular formula of 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione is C17H14N2O4.

What is the molecular weight of 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione?

The molecular weight of 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione is 310.09537 g/mol.

What are the applications of 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione?

5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from...

Where can I buy 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione?

You can request a quote for 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione?

Yes, CoreyChem provides custom synthesis services for 5-Methyl-5-(4-Phenoxy-Phenyl)-Pyrimidine-2,4,6-Trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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