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Methyl [(4-methylbenzoyl)amino]acetate
TL;DR: Methyl [(4-methylbenzoyl)amino]acetate (CAS 1208-23-7) is a chemical compound with molecular formula C11H13NO3 and molecular weight 207.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(4-methylbenzoyl)amino]acetate
Also Known As: Methyl [(4-methylbenzoyl)amino]acetate, methyl 2-(4-methylbenzamido)acetate, methyl 2-[(4-methylphenyl)formamido]acetate, N-(4-Methylbenzoyl)glycine methyl ester, Glycine, N-(p-toluoyl)-, methyl ester
| Molecular Formula | C11H13NO3 |
|---|---|
| Molecular Weight | 207.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 207.08954 |
| Heavy Atoms | 15 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 1208-23-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NCC(=O)OC |
| InChIKey | OIBNTNKRKWKBQG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl [(4-methylbenzoyl)amino]acetate (CAS 1208-23-7), with molecular formula C11H13NO3 and molecular weight 207.09 g/mol. IUPAC: methyl 2-[(4-methylbenzoyl)amino]acetate.
Chemical Property Profile of Methyl [(4-methylbenzoyl)amino]acetate
Property Insights of Methyl [(4-methylbenzoyl)amino]acetate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl [(4-methylbenzoyl)amino]acetate. With a topological polar surface area (TPSA) of 55.4 Ų, Methyl [(4-methylbenzoyl)amino]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl [(4-methylbenzoyl)amino]acetate has 1 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 Methyl [(4-methylbenzoyl)amino]acetate?
The CAS number of Methyl [(4-methylbenzoyl)amino]acetate is 1208-23-7.
What is the molecular formula of Methyl [(4-methylbenzoyl)amino]acetate?
The molecular formula of Methyl [(4-methylbenzoyl)amino]acetate is C11H13NO3.
What is the molecular weight of Methyl [(4-methylbenzoyl)amino]acetate?
The molecular weight of Methyl [(4-methylbenzoyl)amino]acetate is 207.09 g/mol.
Where can I buy Methyl [(4-methylbenzoyl)amino]acetate?
You can request a quote for Methyl [(4-methylbenzoyl)amino]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl [(4-methylbenzoyl)amino]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl [(4-methylbenzoyl)amino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.