1-Methyl-4-phenylpyrimidin-1-ium
TL;DR: 1-Methyl-4-phenylpyrimidin-1-ium (CAS 125708-35-2) is a chemical compound with molecular formula C11H11N2+ and molecular weight 171.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-phenylpyrimidin-1-ium
Also Known As: 1-methyl-4-phenylpyrimidin-1-ium, 1-methyl-4-phenylpyrimidine, 1-Methyl-4-phenyl-1-pyrimidinium
| Molecular Formula | C11H11N2+ |
|---|---|
| Molecular Weight | 171.09 g/mol |
| LogP | 1.5731 |
| Topological Polar Surface Area | 16.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 171.09222 |
| Heavy Atoms | 13 |
| Complexity | 378.59485 |
Chemical Identifiers
| CAS Number | 125708-35-2 |
|---|---|
| SMILES | C[N+]1=CN=C(C=C1)C2=CC=CC=C2 |
Product Overview
1-Methyl-4-phenylpyrimidin-1-ium (CAS 125708-35-2), with molecular formula C11H11N2+ and molecular weight 171.09 g/mol. IUPAC: 1-methyl-4-phenylpyrimidin-1-ium.
Chemical Property Profile of 1-Methyl-4-phenylpyrimidin-1-ium
Property Insights of 1-Methyl-4-phenylpyrimidin-1-ium
The XLogP value of 1.5731 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-4-phenylpyrimidin-1-ium. With a topological polar surface area (TPSA) of 16.77 Ų, 1-Methyl-4-phenylpyrimidin-1-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-4-phenylpyrimidin-1-ium has 0 hydrogen bond donor(s) and 1 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 1-Methyl-4-phenylpyrimidin-1-ium?
The CAS number of 1-Methyl-4-phenylpyrimidin-1-ium is 125708-35-2.
What is the molecular formula of 1-Methyl-4-phenylpyrimidin-1-ium?
The molecular formula of 1-Methyl-4-phenylpyrimidin-1-ium is C11H11N2+.
What is the molecular weight of 1-Methyl-4-phenylpyrimidin-1-ium?
The molecular weight of 1-Methyl-4-phenylpyrimidin-1-ium is 171.09 g/mol.
Where can I buy 1-Methyl-4-phenylpyrimidin-1-ium?
You can request a quote for 1-Methyl-4-phenylpyrimidin-1-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-4-phenylpyrimidin-1-ium?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-4-phenylpyrimidin-1-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.