2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate
TL;DR: 2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate (CAS 68134-26-9) is a chemical compound with molecular formula C40H78N2O2 and molecular weight 618.61 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-heptadecyl-4,5-dihydroimidazol-1-yl)ethyl octadecanoate
Also Known As: 2- ethylstearate, 2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate, 2-(2-heptadecyl-4,5-dihydroimidazol-1-yl)ethyl octadecanoate, 2-(2-heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl octadecanoate, Octadecanoic acid 2-[(2-heptadecyl-4,5-dihydro-1H-imidazol)-1-yl]ethyl ester
| Molecular Formula | C40H78N2O2 |
|---|---|
| Molecular Weight | 618.61 g/mol |
| LogP | 16.1 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 36 |
| Exact Mass | 618.6063 |
| Heavy Atoms | 44 |
| Complexity | 635.0 |
Chemical Identifiers
| CAS Number | 68134-26-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC1=NCCN1CCOC(=O)CCCCCCCCCCCCCCCCC |
| InChIKey | BEGOFGGVFXBVLG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate (CAS 68134-26-9), with molecular formula C40H78N2O2 and molecular weight 618.61 g/mol. IUPAC: 2-(2-heptadecyl-4,5-dihydroimidazol-1-yl)ethyl octadecanoate.
Chemical Property Profile of 2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate
Property Insights of 2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate
The XLogP value of 16.1 indicates that 2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.9 Ų, 2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate?
The CAS number of 2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate is 68134-26-9.
What is the molecular formula of 2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate?
The molecular formula of 2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate is C40H78N2O2.
What is the molecular weight of 2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate?
The molecular weight of 2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate is 618.61 g/mol.
Where can I buy 2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate?
You can request a quote for 2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl stearate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.