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RefChem:304835 structure
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RefChem:304835

TL;DR: RefChem:304835 (CAS 112024-97-2) is a chemical compound with molecular formula C15H16F2N2O4 and molecular weight 326.10782 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

ethyl 4-[2-(difluoromethoxy)phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate

Also Known As: BAS 01912075, 5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-(2-(difluoromethoxy)phenyl)-6-methyl-2-oxo-,ethyl ester, ethyl 4-[2-(difluoromethoxy)phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate, Ethyl 6-[2-(difluoromethoxy)phenyl]-2-hydroxy-4-methyl-1,6-dihydropyrimidine-5-carboxylate, BRN 5613602

CAS Number
112024-97-2
Molecular Formula
C15H16F2N2O4
Molecular Weight
326.10782 g/mol
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Technical Specifications

Molecular FormulaC15H16F2N2O4
Molecular Weight326.10782 g/mol
XLogP2.3
Topological Polar Surface Area (TPSA)76.7 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors6
Rotatable Bonds6
Exact Mass326.10782 Da
Heavy Atoms23
Complexity496.0
SMILESCCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2OC(F)F)C
InChIKeyRJEWIVNHUVUIRA-UHFFFAOYSA-N

Chemical Property Profile of RefChem:304835

XLogP
2.3
TPSA (Topological Polar Surface Area)
76.7
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
6
Heavy Atoms
23
Complexity
496.0
Exact Mass
326.10782
Monoisotopic Mass
326.10782
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 RefChem:304835

The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:304835. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:304835. Following Lipinski's Rule of Five, RefChem:304835 has 2 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 RefChem:304835?

The CAS number of RefChem:304835 is 112024-97-2.

What is the molecular formula of RefChem:304835?

The molecular formula of RefChem:304835 is C15H16F2N2O4.

What is the molecular weight of RefChem:304835?

The molecular weight of RefChem:304835 is 326.10782 g/mol.

Where can I buy RefChem:304835?

You can request a quote for RefChem:304835 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:304835?

Yes, CoreyChem provides custom synthesis services for RefChem:304835 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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