2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol
TL;DR: 2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol (CAS 80018-42-4) is a chemical compound with molecular formula C17H17ClFNO and molecular weight 305.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[N-butyl-C-(4-chlorophenyl)carbonimidoyl]-4-fluorophenol
Also Known As: 2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol, Phenol, 2-((butylimino)(4-chlorophenyl)methyl)-4-fluoro-, Phenol,2-[(butylimino)(4-chlorophenyl)methyl]-4-fluoro-, 2-[(butylimino)(4-chlorophenyl)methyl]-4-fluorophenol, N-Butyl(4-chlorophenyl)(2-hydroxy-5-fluorophenyl)methanimine
| Molecular Formula | C17H17ClFNO |
|---|---|
| Molecular Weight | 305.10 g/mol |
| LogP | 4.8222 |
| Topological Polar Surface Area | 32.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 305.09827 |
| Heavy Atoms | 21 |
| Complexity | 637.7384 |
Chemical Identifiers
| CAS Number | 80018-42-4 |
|---|---|
| SMILES | CCCCN=C(C1=CC=C(C=C1)Cl)C2=C(C=CC(=C2)F)O |
Product Overview
2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol (CAS 80018-42-4), with molecular formula C17H17ClFNO and molecular weight 305.10 g/mol. IUPAC: 2-[N-butyl-C-(4-chlorophenyl)carbonimidoyl]-4-fluorophenol.
Chemical Property Profile of 2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol
Property Insights of 2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol
The XLogP value of 4.8222 indicates that 2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.59 Ų, 2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol 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 2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol?
The CAS number of 2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol is 80018-42-4.
What is the molecular formula of 2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol?
The molecular formula of 2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol is C17H17ClFNO.
What is the molecular weight of 2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol?
The molecular weight of 2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol is 305.10 g/mol.
Where can I buy 2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol?
You can request a quote for 2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol?
Yes, KEHONG BIO provides custom synthesis services for 2-((Butylimino)(4-chlorophenyl)methyl)-4-fluorophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.