![[2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate structure](/static/products/128/1286883-13-3.png)
[2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate
TL;DR: [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate (CAS 1286883-13-3) is a chemical compound with molecular formula C20H23FN2O3 and molecular weight 358.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate
Also Known As: [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate
| Molecular Formula | C20H23FN2O3 |
|---|---|
| Molecular Weight | 358.17 g/mol |
| LogP | 2.93362 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 358.16928 |
| Heavy Atoms | 26 |
| Complexity | 749.97644 |
Chemical Identifiers
| CAS Number | 1286883-13-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)OCC(=O)NCCCN(C)C2=CC=CC=C2)F |
Product Overview
[2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate (CAS 1286883-13-3), with molecular formula C20H23FN2O3 and molecular weight 358.17 g/mol. IUPAC: [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate.
Chemical Property Profile of [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate
Property Insights of [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate
The XLogP value of 2.93362 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate. With a topological polar surface area (TPSA) of 58.64 Ų, [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate 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 [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate?
The CAS number of [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate is 1286883-13-3.
What is the molecular formula of [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate?
The molecular formula of [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate is C20H23FN2O3.
What is the molecular weight of [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate?
The molecular weight of [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate is 358.17 g/mol.
Where can I buy [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate?
You can request a quote for [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.