![1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium structure](/static/products/5499/54997-93-2.webp)
1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium
TL;DR: 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium (CAS 54997-93-2) is a chemical compound with molecular formula C11H13N4+ and molecular weight 201.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-(pyridin-1-ium-1-ylmethyl)pyrimidin-4-amine
Also Known As: Heteropyrithiamine, 1-[(4-amino-2-methylpyrimidin-5-yl)methyl]pyridinium, 2-methyl-5-(pyridin-1-ium-1-ylmethyl)pyrimidin-4-amine, J2.739.420E, 1-[(4-Amino-2-methyl-5-pyrimidinyl)methyl]pyridinium
| Molecular Formula | C11H13N4+ |
|---|---|
| Molecular Weight | 201.11 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 55.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 201.11403 |
| Heavy Atoms | 15 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 54997-93-2 |
|---|---|
| SMILES | CC1=NC=C(C(=N1)N)C[N+]2=CC=CC=C2 |
| InChIKey | SPQICHFDXHERAC-UHFFFAOYSA-N |
Product Overview
1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium (CAS 54997-93-2), with molecular formula C11H13N4+ and molecular weight 201.11 g/mol. IUPAC: 2-methyl-5-(pyridin-1-ium-1-ylmethyl)pyrimidin-4-amine.
Chemical Property Profile of 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium
Property Insights of 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium. With a topological polar surface area (TPSA) of 55.7 Ų, 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium has 1 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 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium?
The CAS number of 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium is 54997-93-2.
What is the molecular formula of 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium?
The molecular formula of 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium is C11H13N4+.
What is the molecular weight of 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium?
The molecular weight of 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium is 201.11 g/mol.
Where can I buy 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium?
You can request a quote for 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.