Methyl 4-(acetylamino)-2-methoxybenzoate
TL;DR: Methyl 4-(acetylamino)-2-methoxybenzoate (CAS 4093-29-2) is a chemical compound with molecular formula C11H13NO4 and molecular weight 223.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-acetamido-2-methoxybenzoate
Also Known As: Methyl 4-acetamido-2-methoxybenzoate, Metoclopramide EP Impurity D, Methyl 4-acetamido-o-anisate, methyl 4-(acetylamino)-2-methoxybenzoate, Methyl 4-(acetylamino)-o-anisate
| Molecular Formula | C11H13NO4 |
|---|---|
| Molecular Weight | 223.08 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 223.08446 |
| Heavy Atoms | 16 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 4093-29-2 |
|---|---|
| SMILES | CC(=O)NC1=CC(=C(C=C1)C(=O)OC)OC |
| InChIKey | OERVVBDWGVOBIS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 4-(acetylamino)-2-methoxybenzoate (CAS 4093-29-2), with molecular formula C11H13NO4 and molecular weight 223.08 g/mol. IUPAC: methyl 4-acetamido-2-methoxybenzoate.
Chemical Property Profile of Methyl 4-(acetylamino)-2-methoxybenzoate
Property Insights of Methyl 4-(acetylamino)-2-methoxybenzoate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-(acetylamino)-2-methoxybenzoate. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-(acetylamino)-2-methoxybenzoate. Following Lipinski's Rule of Five, Methyl 4-(acetylamino)-2-methoxybenzoate 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 Methyl 4-(acetylamino)-2-methoxybenzoate?
The CAS number of Methyl 4-(acetylamino)-2-methoxybenzoate is 4093-29-2.
What is the molecular formula of Methyl 4-(acetylamino)-2-methoxybenzoate?
The molecular formula of Methyl 4-(acetylamino)-2-methoxybenzoate is C11H13NO4.
What is the molecular weight of Methyl 4-(acetylamino)-2-methoxybenzoate?
The molecular weight of Methyl 4-(acetylamino)-2-methoxybenzoate is 223.08 g/mol.
Where can I buy Methyl 4-(acetylamino)-2-methoxybenzoate?
You can request a quote for Methyl 4-(acetylamino)-2-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-(acetylamino)-2-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-(acetylamino)-2-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.