Ethyl ({2-nitrobenzoyl}anilino)acetate
TL;DR: Ethyl ({2-nitrobenzoyl}anilino)acetate (CAS 5845-33-0) is a chemical compound with molecular formula C17H16N2O5 and molecular weight 328.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(N-(2-nitrobenzoyl)anilino)acetate
Also Known As: Ethyl ({2-nitrobenzoyl}, ethyl ({2-nitrobenzoyl}anilino)acetate, ethyl 2-(N-(2-nitrobenzoyl)anilino)acetate, AR-299/42656395
| Molecular Formula | C17H16N2O5 |
|---|---|
| Molecular Weight | 328.11 g/mol |
| LogP | 2.8047 |
| Topological Polar Surface Area | 89.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 328.10593 |
| Heavy Atoms | 24 |
| Complexity | 745.65594 |
Chemical Identifiers
| CAS Number | 5845-33-0 |
|---|---|
| SMILES | CCOC(=O)CN(C1=CC=CC=C1)C(=O)C2=CC=CC=C2[N+](=O)[O-] |
Product Overview
Ethyl ({2-nitrobenzoyl}anilino)acetate (CAS 5845-33-0), with molecular formula C17H16N2O5 and molecular weight 328.11 g/mol. IUPAC: ethyl 2-(N-(2-nitrobenzoyl)anilino)acetate.
Chemical Property Profile of Ethyl ({2-nitrobenzoyl}anilino)acetate
Property Insights of Ethyl ({2-nitrobenzoyl}anilino)acetate
The XLogP value of 2.8047 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl ({2-nitrobenzoyl}anilino)acetate. The TPSA of 89.75 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl ({2-nitrobenzoyl}anilino)acetate. Following Lipinski's Rule of Five, Ethyl ({2-nitrobenzoyl}anilino)acetate has 0 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 Ethyl ({2-nitrobenzoyl}anilino)acetate?
The CAS number of Ethyl ({2-nitrobenzoyl}anilino)acetate is 5845-33-0.
What is the molecular formula of Ethyl ({2-nitrobenzoyl}anilino)acetate?
The molecular formula of Ethyl ({2-nitrobenzoyl}anilino)acetate is C17H16N2O5.
What is the molecular weight of Ethyl ({2-nitrobenzoyl}anilino)acetate?
The molecular weight of Ethyl ({2-nitrobenzoyl}anilino)acetate is 328.11 g/mol.
Where can I buy Ethyl ({2-nitrobenzoyl}anilino)acetate?
You can request a quote for Ethyl ({2-nitrobenzoyl}anilino)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl ({2-nitrobenzoyl}anilino)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl ({2-nitrobenzoyl}anilino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.