![[2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate structure](/static/products/956/956410-33-6.png)
[2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate
TL;DR: [2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate (CAS 956410-33-6) is a chemical compound with molecular formula C22H20FN3O5 and molecular weight 425.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate
Also Known As: [2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate, (4-methoxyphenyl)carbamoylmethyl 3-[3-(4-fluorophenyl)-4-formyl-pyrazol-1-yl]propanoate, [(4-methoxyphenyl)carbamoyl]methyl 3-[3-(4-fluorophenyl)-4-formyl-1H-pyrazol-1-yl]propanoate
| Molecular Formula | C22H20FN3O5 |
|---|---|
| Molecular Weight | 425.14 g/mol |
| LogP | 3.0823 |
| Topological Polar Surface Area | 99.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 425.1387 |
| Heavy Atoms | 31 |
| Complexity | 1061.7554 |
Chemical Identifiers
| CAS Number | 956410-33-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)COC(=O)CCN2C=C(C(=N2)C3=CC=C(C=C3)F)C=O |
Product Overview
[2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate (CAS 956410-33-6), with molecular formula C22H20FN3O5 and molecular weight 425.14 g/mol. IUPAC: [2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate.
Chemical Property Profile of [2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate
Property Insights of [2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate
The XLogP value of 3.0823 indicates that [2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.52 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate. Following Lipinski's Rule of Five, [2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate has 1 hydrogen bond donor(s) and 6 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-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate?
The CAS number of [2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate is 956410-33-6.
What is the molecular formula of [2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate?
The molecular formula of [2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate is C22H20FN3O5.
What is the molecular weight of [2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate?
The molecular weight of [2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate is 425.14 g/mol.
Where can I buy [2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate?
You can request a quote for [2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate?
Yes, KEHONG BIO provides custom synthesis services for [2-(4-methoxyanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-4-formylpyrazol-1-yl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.