1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole
TL;DR: 1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole (CAS 400086-69-3) is a chemical compound with molecular formula C17H15ClN2O2 and molecular weight 314.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-(4-methoxyphenyl)-1-prop-2-enoxybenzimidazole
Also Known As: 7G-399S, 1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole, 6-chloro-2-(4-methoxyphenyl)-1-prop-2-enoxybenzimidazole, 6-chloro-2-(4-methoxyphenyl)-1-prop-2-enoxy-benzoimidazole, 6-chloro-2-(4-methoxyphenyl)-1-(prop-2-en-1-yloxy)-1H-1,3-benzodiazole
| Molecular Formula | C17H15ClN2O2 |
|---|---|
| Molecular Weight | 314.08 g/mol |
| LogP | 3.9799 |
| Topological Polar Surface Area | 36.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 314.0822 |
| Heavy Atoms | 22 |
| Complexity | 809.387 |
Chemical Identifiers
| CAS Number | 400086-69-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NC3=C(N2OCC=C)C=C(C=C3)Cl |
Product Overview
1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole (CAS 400086-69-3), with molecular formula C17H15ClN2O2 and molecular weight 314.08 g/mol. IUPAC: 6-chloro-2-(4-methoxyphenyl)-1-prop-2-enoxybenzimidazole.
Chemical Property Profile of 1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole
Property Insights of 1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole
The XLogP value of 3.9799 indicates that 1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.28 Ų, 1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole has 0 hydrogen bond donor(s) and 3 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-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole?
The CAS number of 1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole is 400086-69-3.
What is the molecular formula of 1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole?
The molecular formula of 1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole is C17H15ClN2O2.
What is the molecular weight of 1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole?
The molecular weight of 1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole is 314.08 g/mol.
Where can I buy 1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole?
You can request a quote for 1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(allyloxy)-6-chloro-2-(4-methoxyphenyl)-1H-1,3-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.