1,3-Dibenzylbenzimidazol-3-ium
TL;DR: 1,3-Dibenzylbenzimidazol-3-ium (CAS 4439-12-7) is a chemical compound with molecular formula C21H19N2+ and molecular weight 299.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dibenzylbenzimidazol-3-ium
Also Known As: 1,3-dibenzylbenzimidazol-3-ium, 1,3-dibenzylbenzoimidazole, 1,3-dibenzyl-1H-benzimidazol-3-ium, 1,3-dibenzyl-1H-1,3-benzimidazol-3-ium, 1,3-dibenzylbenzimidazol-3-ium;chloride
| Molecular Formula | C21H19N2+ |
|---|---|
| Molecular Weight | 299.15 g/mol |
| LogP | 4.0254 |
| Topological Polar Surface Area | 8.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.15482 |
| Heavy Atoms | 23 |
| Complexity | 832.90497 |
Chemical Identifiers
| CAS Number | 4439-12-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C=[N+](C3=CC=CC=C32)CC4=CC=CC=C4 |
Product Overview
1,3-Dibenzylbenzimidazol-3-ium (CAS 4439-12-7), with molecular formula C21H19N2+ and molecular weight 299.15 g/mol. IUPAC: 1,3-dibenzylbenzimidazol-3-ium.
Chemical Property Profile of 1,3-Dibenzylbenzimidazol-3-ium
Property Insights of 1,3-Dibenzylbenzimidazol-3-ium
The XLogP value of 4.0254 indicates that 1,3-Dibenzylbenzimidazol-3-ium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 8.81 Ų, 1,3-Dibenzylbenzimidazol-3-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dibenzylbenzimidazol-3-ium has 0 hydrogen bond donor(s) and 0 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 1,3-Dibenzylbenzimidazol-3-ium?
The CAS number of 1,3-Dibenzylbenzimidazol-3-ium is 4439-12-7.
What is the molecular formula of 1,3-Dibenzylbenzimidazol-3-ium?
The molecular formula of 1,3-Dibenzylbenzimidazol-3-ium is C21H19N2+.
What is the molecular weight of 1,3-Dibenzylbenzimidazol-3-ium?
The molecular weight of 1,3-Dibenzylbenzimidazol-3-ium is 299.15 g/mol.
Where can I buy 1,3-Dibenzylbenzimidazol-3-ium?
You can request a quote for 1,3-Dibenzylbenzimidazol-3-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dibenzylbenzimidazol-3-ium?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dibenzylbenzimidazol-3-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.