![[2-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate structure](/static/products/3898/389812-71-9.webp)
[2-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate
TL;DR: [2-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate (CAS 389812-71-9) is a chemical compound with molecular formula C16H15ClN2O3 and molecular weight 318.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate
Also Known As: AB00749423-01, [2-(4-ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate, 2-[(4-ethylphenyl)amino]-2-oxoethyl 2-chloropyridine-3-carboxylate, [(4-ETHYLPHENYL)CARBAMOYL]METHYL 2-CHLOROPYRIDINE-3-CARBOXYLATE
| Molecular Formula | C16H15ClN2O3 |
|---|---|
| Molecular Weight | 318.08 g/mol |
| LogP | 3.0929 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.07712 |
| Heavy Atoms | 22 |
| Complexity | 671.34607 |
Chemical Identifiers
| CAS Number | 389812-71-9 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)NC(=O)COC(=O)C2=C(N=CC=C2)Cl |
Product Overview
[2-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate (CAS 389812-71-9), with molecular formula C16H15ClN2O3 and molecular weight 318.08 g/mol. IUPAC: [2-(4-ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate.
Chemical Property Profile of [2-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate
Property Insights of [2-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate
The XLogP value of 3.0929 indicates that [2-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate. Following Lipinski's Rule of Five, [2-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate 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-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate?
The CAS number of [2-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate is 389812-71-9.
What is the molecular formula of [2-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate?
The molecular formula of [2-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate is C16H15ClN2O3.
What is the molecular weight of [2-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate?
The molecular weight of [2-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate is 318.08 g/mol.
Where can I buy [2-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate?
You can request a quote for [2-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-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-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-(4-Ethylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.