Methyl 5-((4-aminophenyl)methyl)anthranilate
TL;DR: Methyl 5-((4-aminophenyl)methyl)anthranilate (CAS 51947-52-5) is a chemical compound with molecular formula C15H16N2O2 and molecular weight 256.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-amino-5-[(4-aminophenyl)methyl]benzoate
Also Known As: methyl5-[ methyl]anthranilate, methyl 2-amino-5-[(4-aminophenyl)methyl]benzoate, Methyl 5-((4-aminophenyl)methyl)anthranilate, methyl 2-amino-5-(4-aminobenzyl)benzoate, Benzoic acid, 2-amino-5-[(4-aminophenyl)methyl]-, methyl ester
| Molecular Formula | C15H16N2O2 |
|---|---|
| Molecular Weight | 256.12 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 78.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 256.1212 |
| Heavy Atoms | 19 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 51947-52-5 |
|---|---|
| SMILES | COC(=O)C1=C(C=CC(=C1)CC2=CC=C(C=C2)N)N |
| InChIKey | QEJNFWVQDMOATI-UHFFFAOYSA-N |
Product Overview
Methyl 5-((4-aminophenyl)methyl)anthranilate (CAS 51947-52-5), with molecular formula C15H16N2O2 and molecular weight 256.12 g/mol. IUPAC: methyl 2-amino-5-[(4-aminophenyl)methyl]benzoate.
Chemical Property Profile of Methyl 5-((4-aminophenyl)methyl)anthranilate
Property Insights of Methyl 5-((4-aminophenyl)methyl)anthranilate
The XLogP value of 3.1 indicates that Methyl 5-((4-aminophenyl)methyl)anthranilate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-((4-aminophenyl)methyl)anthranilate. Following Lipinski's Rule of Five, Methyl 5-((4-aminophenyl)methyl)anthranilate 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 Methyl 5-((4-aminophenyl)methyl)anthranilate?
The CAS number of Methyl 5-((4-aminophenyl)methyl)anthranilate is 51947-52-5.
What is the molecular formula of Methyl 5-((4-aminophenyl)methyl)anthranilate?
The molecular formula of Methyl 5-((4-aminophenyl)methyl)anthranilate is C15H16N2O2.
What is the molecular weight of Methyl 5-((4-aminophenyl)methyl)anthranilate?
The molecular weight of Methyl 5-((4-aminophenyl)methyl)anthranilate is 256.12 g/mol.
Where can I buy Methyl 5-((4-aminophenyl)methyl)anthranilate?
You can request a quote for Methyl 5-((4-aminophenyl)methyl)anthranilate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-((4-aminophenyl)methyl)anthranilate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-((4-aminophenyl)methyl)anthranilate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.