2-Phenylimidazoline
TL;DR: 2-Phenylimidazoline (CAS 681847-92-7) is a chemical compound with molecular formula C18H18BrFN2O and molecular weight 376.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-fluorophenyl]-4,5-dihydro-1H-imidazole
Also Known As: 2-Phenylimidazoline, ML 00253764 hydrochloride, ML 00253764, ML00253764?, 2-(2-(2-(5-bromo-2-methoxyphenyl)ethyl)-3-fluorophenyl)-4,5-dihydro-1h-imidazole
| Molecular Formula | C18H18BrFN2O |
|---|---|
| Molecular Weight | 376.06 g/mol |
| LogP | 3.7318 |
| Topological Polar Surface Area | 33.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 376.05865 |
| Heavy Atoms | 23 |
| Complexity | 745.7966 |
Chemical Identifiers
| CAS Number | 681847-92-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Br)CCC2=C(C=CC=C2F)C3=NCCN3 |
Product Overview
2-Phenylimidazoline (CAS 681847-92-7), with molecular formula C18H18BrFN2O and molecular weight 376.06 g/mol. IUPAC: 2-[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-fluorophenyl]-4,5-dihydro-1H-imidazole.
Chemical Property Profile of 2-Phenylimidazoline
Property Insights of 2-Phenylimidazoline
The XLogP value of 3.7318 indicates that 2-Phenylimidazoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.62 Ų, 2-Phenylimidazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenylimidazoline has 1 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 2-Phenylimidazoline?
The CAS number of 2-Phenylimidazoline is 681847-92-7.
What is the molecular formula of 2-Phenylimidazoline?
The molecular formula of 2-Phenylimidazoline is C18H18BrFN2O.
What is the molecular weight of 2-Phenylimidazoline?
The molecular weight of 2-Phenylimidazoline is 376.06 g/mol.
Where can I buy 2-Phenylimidazoline?
You can request a quote for 2-Phenylimidazoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phenylimidazoline?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenylimidazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.