![4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid structure](/static/products/7008/700851-95-2.webp)
4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid
TL;DR: 4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid (CAS 700851-95-2) is a chemical compound with molecular formula C23H23NO4 and molecular weight 377.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid
Also Known As: 4-(4-Benzyloxy-3-ethoxy-benzylamino)-benzoic acid, AN-465/41988524, 4-[(3-ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid, 4-{[4-(benzyloxy)-3-ethoxybenzyl]amino}benzoic acid, 4-{[4-(benzyloxy)-3-ethoxybenzyl]amino}benzoicacid
| Molecular Formula | C23H23NO4 |
|---|---|
| Molecular Weight | 377.16 g/mol |
| LogP | 4.9746 |
| Topological Polar Surface Area | 67.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 377.16272 |
| Heavy Atoms | 28 |
| Complexity | 907.64526 |
Chemical Identifiers
| CAS Number | 700851-95-2 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)CNC2=CC=C(C=C2)C(=O)O)OCC3=CC=CC=C3 |
Product Overview
4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid (CAS 700851-95-2), with molecular formula C23H23NO4 and molecular weight 377.16 g/mol. IUPAC: 4-[(3-ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid.
Chemical Property Profile of 4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid
Property Insights of 4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid
The XLogP value of 4.9746 indicates that 4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.79 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid. Following Lipinski's Rule of Five, 4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid has 2 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 4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid?
The CAS number of 4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid is 700851-95-2.
What is the molecular formula of 4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid?
The molecular formula of 4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid is C23H23NO4.
What is the molecular weight of 4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid?
The molecular weight of 4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid is 377.16 g/mol.
Where can I buy 4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid?
You can request a quote for 4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]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-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3-Ethoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.