![[2-(4-Ethylanilino)-2-oxoethyl] 4-formylbenzoate structure](/static/products/1004/1004160-05-7.webp)
[2-(4-Ethylanilino)-2-oxoethyl] 4-formylbenzoate
TL;DR: [2-(4-Ethylanilino)-2-oxoethyl] 4-formylbenzoate (CAS 1004160-05-7) is a chemical compound with molecular formula C18H17NO4 and molecular weight 311.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-ethylanilino)-2-oxoethyl] 4-formylbenzoate
Also Known As: [2-(4-ethylanilino)-2-oxoethyl] 4-formylbenzoate|2-[(4-ethylphenyl)amino]-2-oxoethyl 4-formylbenzoate|[(4-ETHYLPHENYL)CARBAMOYL]METHYL 4-FORMYLBENZOATE|EN300-1186825
| Molecular Formula | C18H17NO4 |
|---|---|
| Molecular Weight | 311.12 g/mol |
| LogP | 2.857 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 311.11575 |
| Heavy Atoms | 23 |
| Complexity | 689.96643 |
Chemical Identifiers
| CAS Number | 1004160-05-7 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C=O |
Product Overview
[2-(4-Ethylanilino)-2-oxoethyl] 4-formylbenzoate (CAS 1004160-05-7), with molecular formula C18H17NO4 and molecular weight 311.12 g/mol. IUPAC: [2-(4-ethylanilino)-2-oxoethyl] 4-formylbenzoate.
Chemical Property Profile of [2-(4-Ethylanilino)-2-oxoethyl] 4-formylbenzoate
Property Insights of [2-(4-Ethylanilino)-2-oxoethyl] 4-formylbenzoate
The XLogP value of 2.857 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(4-Ethylanilino)-2-oxoethyl] 4-formylbenzoate. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(4-Ethylanilino)-2-oxoethyl] 4-formylbenzoate. Following Lipinski's Rule of Five, [2-(4-Ethylanilino)-2-oxoethyl] 4-formylbenzoate 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] 4-formylbenzoate?
The CAS number of [2-(4-Ethylanilino)-2-oxoethyl] 4-formylbenzoate is 1004160-05-7.
What is the molecular formula of [2-(4-Ethylanilino)-2-oxoethyl] 4-formylbenzoate?
The molecular formula of [2-(4-Ethylanilino)-2-oxoethyl] 4-formylbenzoate is C18H17NO4.
What is the molecular weight of [2-(4-Ethylanilino)-2-oxoethyl] 4-formylbenzoate?
The molecular weight of [2-(4-Ethylanilino)-2-oxoethyl] 4-formylbenzoate is 311.12 g/mol.
Where can I buy [2-(4-Ethylanilino)-2-oxoethyl] 4-formylbenzoate?
You can request a quote for [2-(4-Ethylanilino)-2-oxoethyl] 4-formylbenzoate 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] 4-formylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-(4-Ethylanilino)-2-oxoethyl] 4-formylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.