![[2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate structure](/static/products/857/857041-59-9.png)
[2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate
TL;DR: [2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate (CAS 857041-59-9) is a chemical compound with molecular formula C17H13FN2O3 and molecular weight 312.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate
Also Known As: [2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate|2-(4-Fluoroanilino)-2-oxoethyl 1H-indole-3-carboxylate|MLS002166535|SMR001248882
| Molecular Formula | C17H13FN2O3 |
|---|---|
| Molecular Weight | 312.09 g/mol |
| LogP | 3.1025 |
| Topological Polar Surface Area | 71.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.09103 |
| Heavy Atoms | 23 |
| Complexity | 855.6608 |
Chemical Identifiers
| CAS Number | 857041-59-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)C(=O)OCC(=O)NC3=CC=C(C=C3)F |
Product Overview
[2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate (CAS 857041-59-9), with molecular formula C17H13FN2O3 and molecular weight 312.09 g/mol. IUPAC: [2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate.
Chemical Property Profile of [2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate
Property Insights of [2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate
The XLogP value of 3.1025 indicates that [2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.19 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate. Following Lipinski's Rule of Five, [2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate has 2 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-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate?
The CAS number of [2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate is 857041-59-9.
What is the molecular formula of [2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate?
The molecular formula of [2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate is C17H13FN2O3.
What is the molecular weight of [2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate?
The molecular weight of [2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate is 312.09 g/mol.
Where can I buy [2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate?
You can request a quote for [2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-(4-fluoroanilino)-2-oxoethyl] 1H-indole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.