1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone
TL;DR: 1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone (CAS 868255-64-5) is a chemical compound with molecular formula C16H14F3NO and molecular weight 293.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)-3-(2,3,4-trifluoroanilino)propan-1-one
Also Known As: 1-(4-methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone, 1-(4-methylphenyl)-3-(2,3,4-trifluoroanilino)propan-1-one, 1-(4-methylphenyl)-3-[(2,3,4-trifluorophenyl)amino]propan-1-one
| Molecular Formula | C16H14F3NO |
|---|---|
| Molecular Weight | 293.10 g/mol |
| LogP | 4.09722 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 293.10275 |
| Heavy Atoms | 21 |
| Complexity | 653.31683 |
Chemical Identifiers
| CAS Number | 868255-64-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)CCNC2=C(C(=C(C=C2)F)F)F |
Product Overview
1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone (CAS 868255-64-5), with molecular formula C16H14F3NO and molecular weight 293.10 g/mol. IUPAC: 1-(4-methylphenyl)-3-(2,3,4-trifluoroanilino)propan-1-one.
Chemical Property Profile of 1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone
Property Insights of 1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone
The XLogP value of 4.09722 indicates that 1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone 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 1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone?
The CAS number of 1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone is 868255-64-5.
What is the molecular formula of 1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone?
The molecular formula of 1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone is C16H14F3NO.
What is the molecular weight of 1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone?
The molecular weight of 1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone is 293.10 g/mol.
Where can I buy 1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone?
You can request a quote for 1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methylphenyl)-3-(2,3,4-trifluoroanilino)-1-propanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.