3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione
TL;DR: 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione (CAS 331983-50-7) is a chemical compound with molecular formula C15H13FN2OS and molecular weight 288.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione
Also Known As: BAS 00731229, 1-[2-(2-fluorophenoxy)ethyl]benzimidazole-2-thiol, 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione, 1-[2-(2-Fluoro-phenoxy)-ethyl]-1H-benzoimidazole-2-thiol, BRD-K76478001-001-06-8
| Molecular Formula | C15H13FN2OS |
|---|---|
| Molecular Weight | 288.07 g/mol |
| LogP | 3.91699 |
| Topological Polar Surface Area | 29.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.07327 |
| Heavy Atoms | 20 |
| Complexity | 793.6679 |
Chemical Identifiers
| CAS Number | 331983-50-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=S)N2CCOC3=CC=CC=C3F |
Product Overview
3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione (CAS 331983-50-7), with molecular formula C15H13FN2OS and molecular weight 288.07 g/mol. IUPAC: 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione.
Chemical Property Profile of 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione
Property Insights of 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione
The XLogP value of 3.91699 indicates that 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.95 Ų, 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione has 1 hydrogen bond donor(s) and 2 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 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione?
The CAS number of 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione is 331983-50-7.
What is the molecular formula of 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione?
The molecular formula of 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione is C15H13FN2OS.
What is the molecular weight of 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione?
The molecular weight of 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione is 288.07 g/mol.
Where can I buy 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione?
You can request a quote for 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(2-fluorophenoxy)ethyl]-1H-benzimidazole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.