2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride
TL;DR: 2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride (CAS 41259-67-0) is a chemical compound with molecular formula C6H13Cl2N3 and molecular weight 197.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-methyl-1H-imidazol-4-yl)ethanamine;dihydrochloride
Also Known As: 4-Methylhistamine dihydrochloride, 4-Methylhistamine, 5-Methylhistamine dihydrochloride, 2-(4-methyl-1h-imidazol-5-yl)ethanamine dihydrochloride, 4-Methylhistamine 2HCl
| Molecular Formula | C6H13Cl2N3 |
|---|---|
| Molecular Weight | 197.05 g/mol |
| LogP | 1.06292 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 197.04866 |
| Heavy Atoms | 11 |
| Complexity | 84.0 |
Chemical Identifiers
| CAS Number | 41259-67-0 |
|---|---|
| SMILES | CC1=C(N=CN1)CCN.Cl.Cl |
| InChIKey | BVJIXYJOFWYOBL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride (CAS 41259-67-0), with molecular formula C6H13Cl2N3 and molecular weight 197.05 g/mol. IUPAC: 2-(5-methyl-1H-imidazol-4-yl)ethanamine;dihydrochloride.
Chemical Property Profile of 2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride
Property Insights of 2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride
The XLogP value of 1.06292 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride. With a topological polar surface area (TPSA) of 54.7 Ų, 2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride has 4 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 2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride?
The CAS number of 2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride is 41259-67-0.
What is the molecular formula of 2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride?
The molecular formula of 2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride is C6H13Cl2N3.
What is the molecular weight of 2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride?
The molecular weight of 2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride is 197.05 g/mol.
Where can I buy 2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride?
You can request a quote for 2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-methyl-1H-imidazol-4-yl)ethan-1-amine dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.