1-Hexylbenzimidazole
TL;DR: 1-Hexylbenzimidazole (CAS 144991-19-5) is a chemical compound with molecular formula C13H18N2 and molecular weight 202.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hexylbenzimidazole
Also Known As: hexylbenzimidazole, 1-hexylbenzimidazole, 1-hexyl-1H-benzo[d]imidazole, 1-Hexyl-1H-benzimidazole, 1-Hexyl-1H-benzoimidazole
| Molecular Formula | C13H18N2 |
|---|---|
| Molecular Weight | 202.15 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 17.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 202.147 |
| Heavy Atoms | 15 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 144991-19-5 |
|---|---|
| SMILES | CCCCCCN1C=NC2=CC=CC=C21 |
| InChIKey | WHZAEEFVNATXKX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Hexylbenzimidazole (CAS 144991-19-5), with molecular formula C13H18N2 and molecular weight 202.15 g/mol. IUPAC: 1-hexylbenzimidazole.
Chemical Property Profile of 1-Hexylbenzimidazole
Property Insights of 1-Hexylbenzimidazole
The XLogP value of 3.7 indicates that 1-Hexylbenzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.8 Ų, 1-Hexylbenzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Hexylbenzimidazole has 0 hydrogen bond donor(s) and 1 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-Hexylbenzimidazole?
The CAS number of 1-Hexylbenzimidazole is 144991-19-5.
What is the molecular formula of 1-Hexylbenzimidazole?
The molecular formula of 1-Hexylbenzimidazole is C13H18N2.
What is the molecular weight of 1-Hexylbenzimidazole?
The molecular weight of 1-Hexylbenzimidazole is 202.15 g/mol.
Where can I buy 1-Hexylbenzimidazole?
You can request a quote for 1-Hexylbenzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hexylbenzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Hexylbenzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.