4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium
TL;DR: 4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium (CAS 74017-55-3) is a chemical compound with molecular formula C11H17N5+2 and molecular weight 219.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dimethyl-5-[(3-methylimidazol-3-ium-1-yl)methyl]pyrimidin-1-ium-4-amine
Also Known As: 1,2-dimethyl-5-[(3-methylimidazol-1-yl)methyl]pyrimidin-4-amine, 4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium, 1,2-dimethyl-5-[(3-methylimidazol-3-ium-1-yl)methyl]pyrimidin-1-ium-4-amine
| Molecular Formula | C11H17N5+2 |
|---|---|
| Molecular Weight | 219.15 g/mol |
| LogP | -0.52898 |
| Topological Polar Surface Area | 51.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 219.14839 |
| Heavy Atoms | 16 |
| Complexity | 515.0886 |
Chemical Identifiers
| CAS Number | 74017-55-3 |
|---|---|
| SMILES | CC1=[N+](C=C(C(=N1)N)CN2C=C[N+](=C2)C)C |
Product Overview
4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium (CAS 74017-55-3), with molecular formula C11H17N5+2 and molecular weight 219.15 g/mol. IUPAC: 1,2-dimethyl-5-[(3-methylimidazol-3-ium-1-yl)methyl]pyrimidin-1-ium-4-amine.
Chemical Property Profile of 4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium
Property Insights of 4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium
The XLogP value of -0.52898 indicates that 4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 51.6 Ų, 4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium 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 4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium?
The CAS number of 4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium is 74017-55-3.
What is the molecular formula of 4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium?
The molecular formula of 4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium is C11H17N5+2.
What is the molecular weight of 4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium?
The molecular weight of 4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium is 219.15 g/mol.
Where can I buy 4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium?
You can request a quote for 4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-1,2-dimethyl-5-((1-methyl-1H-imidazol-3-ium-3-yl)methyl)pyrimidin-1-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.