1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium
TL;DR: 1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium (CAS 47695-36-3) is a chemical compound with molecular formula C29H51N2O+ and molecular weight 443.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-benzyl-2-heptadecyl-4,5-dihydroimidazol-1-ium-1-yl)ethanol
Also Known As: 2-(1-benzyl-2-heptadecyl-4,5-dihydroimidazol-1-yl)ethanol, 1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium, 2-(1-benzyl-2-heptadecyl-4,5-dihydroimidazol-1-ium-1-yl)ethanol
| Molecular Formula | C29H51N2O+ |
|---|---|
| Molecular Weight | 443.40 g/mol |
| LogP | 9.0 |
| Topological Polar Surface Area | 32.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 20 |
| Exact Mass | 443.40015 |
| Heavy Atoms | 32 |
| Complexity | 472.0 |
Chemical Identifiers
| CAS Number | 47695-36-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC1=NCC[N+]1(CCO)CC2=CC=CC=C2 |
| InChIKey | GMPZUCASMVTPKD-UHFFFAOYSA-N |
Product Overview
1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium (CAS 47695-36-3), with molecular formula C29H51N2O+ and molecular weight 443.40 g/mol. IUPAC: 2-(1-benzyl-2-heptadecyl-4,5-dihydroimidazol-1-ium-1-yl)ethanol.
Chemical Property Profile of 1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium
Property Insights of 1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium
The XLogP value of 9.0 indicates that 1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.6 Ų, 1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium?
The CAS number of 1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium is 47695-36-3.
What is the molecular formula of 1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium?
The molecular formula of 1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium is C29H51N2O+.
What is the molecular weight of 1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium?
The molecular weight of 1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium is 443.40 g/mol.
Where can I buy 1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium?
You can request a quote for 1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1H-imidazol-1-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.