Imidazolyl-4-propargylamine
TL;DR: Imidazolyl-4-propargylamine (CAS 6641-07-2) is a chemical compound with molecular formula C1=C(NC=N1)C#CCN and molecular weight 121.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1H-imidazol-5-yl)prop-2-yn-1-amine
Also Known As: Imidazolyl-4-propargylamine, 3-(1H-imidazol-5-yl)prop-2-yn-1-amine, 3-(1h-imidazol-4-yl)prop-2-yn-1-amine, 2-Propyn-1-amine, 3-(1H-imidazol-5-yl)-, 3-(1H-Imidazol-4-yl)-prop-2-ynylamine
| Molecular Formula | C1=C(NC=N1)C#CCN |
|---|---|
| Molecular Weight | 121.06 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 121.063995 |
| Heavy Atoms | 9 |
| Complexity | 141.0 |
Chemical Identifiers
| CAS Number | 6641-07-2 |
|---|---|
| SMILES | C1=C(NC=N1)C#CCN |
| InChIKey | WVTVSENJUPWHIC-UHFFFAOYSA-N |
Product Overview
Imidazolyl-4-propargylamine (CAS 6641-07-2), with molecular formula C1=C(NC=N1)C#CCN and molecular weight 121.06 g/mol. IUPAC: 3-(1H-imidazol-5-yl)prop-2-yn-1-amine.
Chemical Property Profile of Imidazolyl-4-propargylamine
Property Insights of Imidazolyl-4-propargylamine
The XLogP value of -0.7 indicates that Imidazolyl-4-propargylamine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 54.7 Ų, Imidazolyl-4-propargylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Imidazolyl-4-propargylamine has 2 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 Imidazolyl-4-propargylamine?
The CAS number of Imidazolyl-4-propargylamine is 6641-07-2.
What is the molecular formula of Imidazolyl-4-propargylamine?
The molecular formula of Imidazolyl-4-propargylamine is C1=C(NC=N1)C#CCN.
What is the molecular weight of Imidazolyl-4-propargylamine?
The molecular weight of Imidazolyl-4-propargylamine is 121.06 g/mol.
Where can I buy Imidazolyl-4-propargylamine?
You can request a quote for Imidazolyl-4-propargylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Imidazolyl-4-propargylamine?
Yes, KEHONG BIO provides custom synthesis services for Imidazolyl-4-propargylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.