Methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate
TL;DR: Methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate (CAS 433307-86-9) is a chemical compound with molecular formula C17H16N2O6 and molecular weight 344.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate
Also Known As: methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate, METHYL 2-(4-ETHOXY-3-NITROBENZAMIDO)BENZOATE, methyl 2-{[(4-ethoxy-3-nitrophenyl)carbonyl]amino}benzoate
| Molecular Formula | C17H16N2O6 |
|---|---|
| Molecular Weight | 344.10 g/mol |
| LogP | 3.0324 |
| Topological Polar Surface Area | 107.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 344.10083 |
| Heavy Atoms | 25 |
| Complexity | 818.5354 |
Chemical Identifiers
| CAS Number | 433307-86-9 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)OC)[N+](=O)[O-] |
Product Overview
Methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate (CAS 433307-86-9), with molecular formula C17H16N2O6 and molecular weight 344.10 g/mol. IUPAC: methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate.
Chemical Property Profile of Methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate
Property Insights of Methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate
The XLogP value of 3.0324 indicates that Methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.77 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate. Following Lipinski's Rule of Five, Methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate has 1 hydrogen bond donor(s) and 6 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-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate?
The CAS number of Methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate is 433307-86-9.
What is the molecular formula of Methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate?
The molecular formula of Methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate is C17H16N2O6.
What is the molecular weight of Methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate?
The molecular weight of Methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate is 344.10 g/mol.
Where can I buy Methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate?
You can request a quote for Methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[(4-ethoxy-3-nitrobenzoyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.