Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester
TL;DR: Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester (CAS 17224-13-4) is a chemical compound with molecular formula C18H19NO3 and molecular weight 297.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(4-ethoxyphenyl)methylideneamino]benzoate
Also Known As: ethyl 4-[(4-ethoxybenzylidene)amino]benzoate, ethyl 4-[(4-ethoxyphenyl)methylideneamino]benzoate, Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester, Ethyl 4-{(E)-[(4-ethoxyphenyl)methylidene]amino}benzoate, ethyl 4-{[(E)-(4-ethoxyphenyl)methylidene]amino}benzoate
| Molecular Formula | C18H19NO3 |
|---|---|
| Molecular Weight | 297.14 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 47.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 297.1365 |
| Heavy Atoms | 22 |
| Complexity | 353.0 |
Chemical Identifiers
| CAS Number | 17224-13-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C(=O)OCC |
| InChIKey | KHOXQZUPVCAJFD-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester (CAS 17224-13-4), with molecular formula C18H19NO3 and molecular weight 297.14 g/mol. IUPAC: ethyl 4-[(4-ethoxyphenyl)methylideneamino]benzoate.
Chemical Property Profile of Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester
Property Insights of Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester
The XLogP value of 3.8 indicates that Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.9 Ų, Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester has 0 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 Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester?
The CAS number of Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester is 17224-13-4.
What is the molecular formula of Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester?
The molecular formula of Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester is C18H19NO3.
What is the molecular weight of Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester?
The molecular weight of Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester is 297.14 g/mol.
Where can I buy Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester?
You can request a quote for Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4-[[(4-ethoxyphenyl)methylene]amino]-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.