![2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide structure](/static/products/2524/25243-59-8.webp)
2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide
TL;DR: 2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide (CAS 25243-59-8) is a chemical compound with molecular formula C29H31BrCl4N4O4 and molecular weight 718.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide
Also Known As: 1-[2-(acetoxy)ethyl]-2-[3-[3-[2-(acetoxy)ethyl]-5,6-dichloro-1-ethyl-1,3-dihydro-2h-benzo[d]imidazol-2-ylidene]-1-propenyl]-5,6-dichloro-3-ethyl-1h-benzo[d]imidazolium bromide
| Molecular Formula | C29H31BrCl4N4O4 |
|---|---|
| Molecular Weight | 718.03 g/mol |
| LogP | 3.8936 |
| Topological Polar Surface Area | 67.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 718.02826 |
| Heavy Atoms | 42 |
| Complexity | 912.0 |
Chemical Identifiers
| CAS Number | 25243-59-8 |
|---|---|
| SMILES | CCN1C2=CC(=C(C=C2[N+](=C1C=CC=C3N(C4=CC(=C(C=C4N3CCOC(=O)C)Cl)Cl)CC)CCOC(=O)C)Cl)Cl.[Br-] |
| InChIKey | DCHRCSMPQHDKBB-UHFFFAOYSA-M |
Product Overview
2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide (CAS 25243-59-8), with molecular formula C29H31BrCl4N4O4 and molecular weight 718.03 g/mol. IUPAC: 2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide.
Chemical Property Profile of 2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide
Property Insights of 2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide
The XLogP value of 3.8936 indicates that 2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide. Following Lipinski's Rule of Five, 2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide has 0 hydrogen bond donor(s) and 7 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-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide?
The CAS number of 2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide is 25243-59-8.
What is the molecular formula of 2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide?
The molecular formula of 2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide is C29H31BrCl4N4O4.
What is the molecular weight of 2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide?
The molecular weight of 2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide is 718.03 g/mol.
Where can I buy 2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide?
You can request a quote for 2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-[3-[1-(2-acetyloxyethyl)-5,6-dichloro-3-ethylbenzimidazol-1-ium-2-yl]prop-2-enylidene]-5,6-dichloro-3-ethylbenzimidazol-1-yl]ethyl acetate bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.