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5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione
TL;DR: 5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione (CAS 28495-76-3) is a chemical compound with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione
Also Known As: 5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione, 5-(3-Methoxy-benzyl)-1H-pyrimidine-2,4-dione, 2,4(1H,3H)-Pyrimidinedione, 5-[(3-methoxyphenyl)methyl]-, 5-[(3-Methoxyphenyl)methyl]pyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C12H12N2O3 |
|---|---|
| Molecular Weight | 232.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.0848 |
| Heavy Atoms | 17 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 28495-76-3 |
|---|---|
| SMILES | COC1=CC=CC(=C1)CC2=CNC(=O)NC2=O |
| InChIKey | NOFPXZXTKXPRDN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione (CAS 28495-76-3), with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol. IUPAC: 5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione
Property Insights of 5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione. Following Lipinski's Rule of Five, 5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione has 2 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-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione?
The CAS number of 5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione is 28495-76-3.
What is the molecular formula of 5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione?
The molecular formula of 5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione is C12H12N2O3.
What is the molecular weight of 5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione?
The molecular weight of 5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione is 232.08 g/mol.
Where can I buy 5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione?
You can request a quote for 5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(3-methoxyphenyl)methyl]-1H-pyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.