3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone
TL;DR: 3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone (CAS 477328-92-0) is a chemical compound with molecular formula C16H15ClFNO2 and molecular weight 307.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-chloro-2-methoxyanilino)-1-(4-fluorophenyl)propan-1-one
Also Known As: 3-(5-chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone, 3-((5-Chloro-2-methoxyphenyl)amino)-1-(4-fluorophenyl)propan-1-one, 3-(5-chloro-2-methoxyanilino)-1-(4-fluorophenyl)propan-1-one, 3-(5-chloro-2-methoxy-anilino)-1-(4-fluorophenyl)propan-1-one, 3-[(5-chloro-2-methoxy-phenyl)amino]-1-(4-fluorophenyl)propan-1-one
| Molecular Formula | C16H15ClFNO2 |
|---|---|
| Molecular Weight | 307.08 g/mol |
| LogP | 4.1726 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 307.07755 |
| Heavy Atoms | 21 |
| Complexity | 628.67413 |
Chemical Identifiers
| CAS Number | 477328-92-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Cl)NCCC(=O)C2=CC=C(C=C2)F |
Product Overview
3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone (CAS 477328-92-0), with molecular formula C16H15ClFNO2 and molecular weight 307.08 g/mol. IUPAC: 3-(5-chloro-2-methoxyanilino)-1-(4-fluorophenyl)propan-1-one.
Chemical Property Profile of 3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone
Property Insights of 3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone
The XLogP value of 4.1726 indicates that 3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, 3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone 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 3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone?
The CAS number of 3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone is 477328-92-0.
What is the molecular formula of 3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone?
The molecular formula of 3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone is C16H15ClFNO2.
What is the molecular weight of 3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone?
The molecular weight of 3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone is 307.08 g/mol.
Where can I buy 3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone?
You can request a quote for 3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-Chloro-2-methoxyanilino)-1-(4-fluorophenyl)-1-propanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.