![2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate structure](/static/products/6582/6582-85-0.webp)
2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate
TL;DR: 2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate (CAS 6582-85-0) is a chemical compound with molecular formula C21H19N3O5 and molecular weight 393.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[ethyl(naphthalen-1-yl)amino]-2-oxoethyl] 4-amino-3-nitrobenzoate
Also Known As: 2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate, [2-[ethyl(naphthalen-1-yl)amino]-2-oxoethyl] 4-amino-3-nitrobenzoate
| Molecular Formula | C21H19N3O5 |
|---|---|
| Molecular Weight | 393.13 g/mol |
| LogP | 3.5401 |
| Topological Polar Surface Area | 115.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 393.13248 |
| Heavy Atoms | 29 |
| Complexity | 1091.3717 |
Chemical Identifiers
| CAS Number | 6582-85-0 |
|---|---|
| SMILES | CCN(C1=CC=CC2=CC=CC=C21)C(=O)COC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-] |
Product Overview
2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate (CAS 6582-85-0), with molecular formula C21H19N3O5 and molecular weight 393.13 g/mol. IUPAC: [2-[ethyl(naphthalen-1-yl)amino]-2-oxoethyl] 4-amino-3-nitrobenzoate.
Chemical Property Profile of 2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate
Property Insights of 2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate
The XLogP value of 3.5401 indicates that 2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate. Following Lipinski's Rule of Five, 2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate 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 2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate?
The CAS number of 2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate is 6582-85-0.
What is the molecular formula of 2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate?
The molecular formula of 2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate is C21H19N3O5.
What is the molecular weight of 2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate?
The molecular weight of 2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate is 393.13 g/mol.
Where can I buy 2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate?
You can request a quote for 2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[Ethyl(naphthalen-1-yl)amino]-2-oxoethyl 4-amino-3-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.