![Methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate structure](/static/products/333/333350-69-9.png)
Methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate
TL;DR: Methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate (CAS 333350-69-9) is a chemical compound with molecular formula C11H12N2O5 and molecular weight 252.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate
Also Known As: BAS 00785345, methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate, methyl N-[(3-methyl-4-nitrophenyl)carbonyl]glycinate, methyl 2-[(3-methyl-4-nitrophenyl)carbonylamino]acetate, (3-Methyl-4-nitro-benzoylamino)-acetic acid methyl ester
| Molecular Formula | C11H12N2O5 |
|---|---|
| Molecular Weight | 252.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.07462 |
| Heavy Atoms | 18 |
| Complexity | 339.0 |
Chemical Identifiers
| CAS Number | 333350-69-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(=O)NCC(=O)OC)[N+](=O)[O-] |
| InChIKey | QVGXMGDIBGEXQX-UHFFFAOYSA-N |
Product Overview
Methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate (CAS 333350-69-9), with molecular formula C11H12N2O5 and molecular weight 252.07 g/mol. IUPAC: methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate.
Chemical Property Profile of Methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate
Property Insights of Methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate. Following Lipinski's Rule of Five, Methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate has 1 hydrogen bond donor(s) and 5 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 2-[(3-methyl-4-nitrobenzoyl)amino]acetate?
The CAS number of Methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate is 333350-69-9.
What is the molecular formula of Methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate?
The molecular formula of Methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate is C11H12N2O5.
What is the molecular weight of Methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate?
The molecular weight of Methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate is 252.07 g/mol.
Where can I buy Methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate?
You can request a quote for Methyl 2-[(3-methyl-4-nitrobenzoyl)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 2-[(3-methyl-4-nitrobenzoyl)amino]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.