2-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate
TL;DR: 2-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate (CAS 459785-05-8) is a chemical compound with molecular formula C18H19NO4 and molecular weight 313.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2-ethylanilino)-2-oxoethyl] 3-methoxybenzoate
Also Known As: 2-(2-ethylanilino)-2-oxoethyl 3-methoxybenzoate, [2-(2-ethylanilino)-2-oxoethyl] 3-methoxybenzoate, AB00756356-01, AP-964/40952241, 2-[(2-ethylphenyl)amino]-2-oxoethyl 3-methoxybenzoate
| Molecular Formula | C18H19NO4 |
|---|---|
| Molecular Weight | 313.13 g/mol |
| LogP | 3.0531 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 313.1314 |
| Heavy Atoms | 23 |
| Complexity | 696.92584 |
Chemical Identifiers
| CAS Number | 459785-05-8 |
|---|---|
| SMILES | CCC1=CC=CC=C1NC(=O)COC(=O)C2=CC(=CC=C2)OC |
Product Overview
2-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate (CAS 459785-05-8), with molecular formula C18H19NO4 and molecular weight 313.13 g/mol. IUPAC: [2-(2-ethylanilino)-2-oxoethyl] 3-methoxybenzoate.
Chemical Property Profile of 2-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate
Property Insights of 2-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate
The XLogP value of 3.0531 indicates that 2-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate. Following Lipinski's Rule of Five, 2-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate 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-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate?
The CAS number of 2-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate is 459785-05-8.
What is the molecular formula of 2-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate?
The molecular formula of 2-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate is C18H19NO4.
What is the molecular weight of 2-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate?
The molecular weight of 2-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate is 313.13 g/mol.
Where can I buy 2-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate?
You can request a quote for 2-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Ethylanilino)-2-oxoethyl 3-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.