3-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone
TL;DR: 3-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone (CAS 763119-57-9) is a chemical compound with molecular formula C17H17ClFNO3 and molecular weight 337.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)propan-1-one
Also Known As: 3-(3-chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone, 3-((3-Chloro-4-fluorophenyl)amino)-1-(3,4-dimethoxyphenyl)propan-1-one, 3-(3-chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)propan-1-one, 3-[(3-chloro-4-fluoro-phenyl)amino]-1-(3,4-dimethoxyphenyl)propan-1-one, 3-[(3-chloro-4-fluorophenyl)amino]-1-(3,4-dimethoxyphenyl)propan-1-one
| Molecular Formula | C17H17ClFNO3 |
|---|---|
| Molecular Weight | 337.09 g/mol |
| LogP | 4.1812 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 337.0881 |
| Heavy Atoms | 23 |
| Complexity | 706.233 |
Chemical Identifiers
| CAS Number | 763119-57-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)CCNC2=CC(=C(C=C2)F)Cl)OC |
Product Overview
3-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone (CAS 763119-57-9), with molecular formula C17H17ClFNO3 and molecular weight 337.09 g/mol. IUPAC: 3-(3-chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)propan-1-one.
Chemical Property Profile of 3-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone
Property Insights of 3-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone
The XLogP value of 4.1812 indicates that 3-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, 3-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone has 1 hydrogen bond donor(s) and 4 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-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone?
The CAS number of 3-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone is 763119-57-9.
What is the molecular formula of 3-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone?
The molecular formula of 3-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone is C17H17ClFNO3.
What is the molecular weight of 3-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone?
The molecular weight of 3-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone is 337.09 g/mol.
Where can I buy 3-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone?
You can request a quote for 3-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-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-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Chloro-4-fluoroanilino)-1-(3,4-dimethoxyphenyl)-1-propanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.