5-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione
TL;DR: 5-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione (CAS 849502-01-8) is a chemical compound with molecular formula C12H11FN2O2 and molecular weight 234.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-fluorophenyl)methyl]-5-methylpyrimidine-2,4-dione
Also Known As: 1-Pyrenebutanoic acid,decyl ester, 5-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione, 1-[(4-fluorophenyl)methyl]-5-methylpyrimidine-2,4-dione, 1-(4-Fluoro-benzyl)-5-methyl-1H-pyrimidine-2,4-dione, 1-(4-fluorobenzyl)-5-methylpyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C12H11FN2O2 |
|---|---|
| Molecular Weight | 234.08 g/mol |
| LogP | 1.03242 |
| Topological Polar Surface Area | 54.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.08046 |
| Heavy Atoms | 17 |
| Complexity | 640.7906 |
Chemical Identifiers
| CAS Number | 849502-01-8 |
|---|---|
| SMILES | CC1=CN(C(=O)NC1=O)CC2=CC=C(C=C2)F |
Product Overview
5-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione (CAS 849502-01-8), with molecular formula C12H11FN2O2 and molecular weight 234.08 g/mol. IUPAC: 1-[(4-fluorophenyl)methyl]-5-methylpyrimidine-2,4-dione.
Chemical Property Profile of 5-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione
Property Insights of 5-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione
The XLogP value of 1.03242 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione. With a topological polar surface area (TPSA) of 54.86 Ų, 5-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione has 1 hydrogen bond donor(s) and 2 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-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione?
The CAS number of 5-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione is 849502-01-8.
What is the molecular formula of 5-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione?
The molecular formula of 5-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione is C12H11FN2O2.
What is the molecular weight of 5-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione?
The molecular weight of 5-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione is 234.08 g/mol.
Where can I buy 5-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione?
You can request a quote for 5-Methyl-1-(4-fluoro-benzyl)-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-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-1-(4-fluoro-benzyl)-1H-pyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.