Benzoic acid, 4-[[(4-methoxyphenyl)methyl]amino]-, ethyl ester
TL;DR: Benzoic acid, 4-[[(4-methoxyphenyl)methyl]amino]-, ethyl ester (CAS 61439-58-5) is a chemical compound with molecular formula C17H19NO3 and molecular weight 285.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(4-methoxyphenyl)methylamino]benzoate
Also Known As: ethyl N-anisyl-p-aminobenzoate, Ethyl 4-[(4-methoxyphenyl)methylamino]benzoate, Ethyl p-[(p-Methoxybenzyl)amino]benzoate, Benzoic acid, 4-[[(4-methoxyphenyl)methyl]amino]-, ethyl ester, ETHYL 4-{[(4-METHOXYPHENYL)METHYL]AMINO}BENZOATE
| Molecular Formula | C17H19NO3 |
|---|---|
| Molecular Weight | 285.14 g/mol |
| LogP | 3.484 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 285.1365 |
| Heavy Atoms | 21 |
| Complexity | 575.98914 |
Chemical Identifiers
| CAS Number | 61439-58-5 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NCC2=CC=C(C=C2)OC |
Product Overview
Benzoic acid, 4-[[(4-methoxyphenyl)methyl]amino]-, ethyl ester (CAS 61439-58-5), with molecular formula C17H19NO3 and molecular weight 285.14 g/mol. IUPAC: ethyl 4-[(4-methoxyphenyl)methylamino]benzoate.
Chemical Property Profile of Benzoic acid, 4-[[(4-methoxyphenyl)methyl]amino]-, ethyl ester
Property Insights of Benzoic acid, 4-[[(4-methoxyphenyl)methyl]amino]-, ethyl ester
The XLogP value of 3.484 indicates that Benzoic acid, 4-[[(4-methoxyphenyl)methyl]amino]-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, Benzoic acid, 4-[[(4-methoxyphenyl)methyl]amino]-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 4-[[(4-methoxyphenyl)methyl]amino]-, ethyl ester 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 Benzoic acid, 4-[[(4-methoxyphenyl)methyl]amino]-, ethyl ester?
The CAS number of Benzoic acid, 4-[[(4-methoxyphenyl)methyl]amino]-, ethyl ester is 61439-58-5.
What is the molecular formula of Benzoic acid, 4-[[(4-methoxyphenyl)methyl]amino]-, ethyl ester?
The molecular formula of Benzoic acid, 4-[[(4-methoxyphenyl)methyl]amino]-, ethyl ester is C17H19NO3.
What is the molecular weight of Benzoic acid, 4-[[(4-methoxyphenyl)methyl]amino]-, ethyl ester?
The molecular weight of Benzoic acid, 4-[[(4-methoxyphenyl)methyl]amino]-, ethyl ester is 285.14 g/mol.
Where can I buy Benzoic acid, 4-[[(4-methoxyphenyl)methyl]amino]-, ethyl ester?
You can request a quote for Benzoic acid, 4-[[(4-methoxyphenyl)methyl]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-methoxyphenyl)methyl]amino]-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4-[[(4-methoxyphenyl)methyl]amino]-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.