![[2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate structure](/static/products/3912/391258-80-3.webp)
[2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate
TL;DR: [2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate (CAS 391258-80-3) is a chemical compound with molecular formula C16H14FNO3 and molecular weight 287.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate
Also Known As: [2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate|2-[methyl(phenyl)amino]-2-oxoethyl 3-fluorobenzoate|MLS001172574|SMR000590436
| Molecular Formula | C16H14FNO3 |
|---|---|
| Molecular Weight | 287.10 g/mol |
| LogP | 2.6455 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 287.09576 |
| Heavy Atoms | 21 |
| Complexity | 642.98016 |
Chemical Identifiers
| CAS Number | 391258-80-3 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C(=O)COC(=O)C2=CC(=CC=C2)F |
Product Overview
[2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate (CAS 391258-80-3), with molecular formula C16H14FNO3 and molecular weight 287.10 g/mol. IUPAC: [2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate.
Chemical Property Profile of [2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate
Property Insights of [2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate
The XLogP value of 2.6455 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate. With a topological polar surface area (TPSA) of 46.61 Ų, [2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate has 0 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-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate?
The CAS number of [2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate is 391258-80-3.
What is the molecular formula of [2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate?
The molecular formula of [2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate is C16H14FNO3.
What is the molecular weight of [2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate?
The molecular weight of [2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate is 287.10 g/mol.
Where can I buy [2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate?
You can request a quote for [2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-(N-methylanilino)-2-oxoethyl] 3-fluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.