Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride
TL;DR: Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride (CAS 30413-67-3) is a chemical compound with molecular formula C11H13ClN4 and molecular weight 236.08 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 chloride
Also Known As: Neopyrithiamine, Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride, 1-((4-Amino-2-methyl-5-pyrimidinyl)methyl)pyridinium chloride, 1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]pyridin-1-ium chloride, 2-methyl-5-(pyridin-1-ium-1-ylmethyl)pyrimidin-4-amine chloride
| Molecular Formula | C11H13ClN4 |
|---|---|
| Molecular Weight | 236.08 g/mol |
| LogP | -2.29298 |
| Topological Polar Surface Area | 55.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.08287 |
| Heavy Atoms | 16 |
| Complexity | 458.79666 |
Chemical Identifiers
| CAS Number | 30413-67-3 |
|---|---|
| SMILES | CC1=NC=C(C(=N1)N)C[N+]2=CC=CC=C2.[Cl-] |
Product Overview
Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride (CAS 30413-67-3), with molecular formula C11H13ClN4 and molecular weight 236.08 g/mol. IUPAC: 2-methyl-5-(pyridin-1-ium-1-ylmethyl)pyrimidin-4-amine chloride.
Chemical Property Profile of Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride
Property Insights of Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride
The XLogP value of -2.29298 indicates that Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.68 Ų, Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride 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 Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride?
The CAS number of Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride is 30413-67-3.
What is the molecular formula of Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride?
The molecular formula of Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride is C11H13ClN4.
What is the molecular weight of Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride?
The molecular weight of Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride is 236.08 g/mol.
Where can I buy Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride?
You can request a quote for Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride?
Yes, KEHONG BIO provides custom synthesis services for Pyridinium, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.