![4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid structure](/static/products/6568/656815-41-7.webp)
4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid
TL;DR: 4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid (CAS 656815-41-7) is a chemical compound with molecular formula C16H17NO3 and molecular weight 271.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(4-methoxyphenyl)methylamino]methyl]benzoic acid
Also Known As: 4-{[(4-methoxybenzyl)amino]methyl}benzoic acid, 4-{[(4-Methoxybenzyl)amino]methyl}, 4-[[(4-methoxyphenyl)methylamino]methyl]benzoic Acid, 4-[[(4-methoxyphenyl)methylazaniumyl]methyl]benzoate, AN-465/42886114
| Molecular Formula | C16H17NO3 |
|---|---|
| Molecular Weight | 271.12 g/mol |
| LogP | 2.6832 |
| Topological Polar Surface Area | 58.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 271.12085 |
| Heavy Atoms | 20 |
| Complexity | 561.28076 |
Chemical Identifiers
| CAS Number | 656815-41-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CNCC2=CC=C(C=C2)C(=O)O |
Product Overview
4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid (CAS 656815-41-7), with molecular formula C16H17NO3 and molecular weight 271.12 g/mol. IUPAC: 4-[[(4-methoxyphenyl)methylamino]methyl]benzoic acid.
Chemical Property Profile of 4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid
Property Insights of 4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid
The XLogP value of 2.6832 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid. With a topological polar surface area (TPSA) of 58.56 Ų, 4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid has 2 hydrogen bond donor(s) and 3 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 4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid?
The CAS number of 4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid is 656815-41-7.
What is the molecular formula of 4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid?
The molecular formula of 4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid is C16H17NO3.
What is the molecular weight of 4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid?
The molecular weight of 4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid is 271.12 g/mol.
Where can I buy 4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid?
You can request a quote for 4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{[(4-Methoxybenzyl)amino]methyl}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.