![ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate structure](/static/products/4382/4382-10-9.webp)
ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate
TL;DR: ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate (CAS 4382-10-9) 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 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate
Also Known As: ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate, ethyl 3-({3-nitro-2-methylbenzoyl}amino)benzoate, ETHYL 3-(2-METHYL-3-NITROBENZAMIDO)BENZOATE, ethyl 3-[(2-methyl-3-nitrophenyl)carbonylamino]benzoate, ethyl 3-{[(2-methyl-3-nitrophenyl)carbonyl]amino}benzoate
| Molecular Formula | C17H16N2O5 |
|---|---|
| Molecular Weight | 328.11 g/mol |
| LogP | 3.33222 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 328.10593 |
| Heavy Atoms | 24 |
| Complexity | 801.31793 |
Chemical Identifiers
| CAS Number | 4382-10-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C |
Product Overview
ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate (CAS 4382-10-9), with molecular formula C17H16N2O5 and molecular weight 328.11 g/mol. IUPAC: ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate.
Chemical Property Profile of ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate
Property Insights of ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate
The XLogP value of 3.33222 indicates that ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.54 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate. Following Lipinski's Rule of Five, ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate 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 ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate?
The CAS number of ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate is 4382-10-9.
What is the molecular formula of ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate?
The molecular formula of ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate is C17H16N2O5.
What is the molecular weight of ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate?
The molecular weight of ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate is 328.11 g/mol.
Where can I buy ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate?
You can request a quote for ethyl 3-[(2-methyl-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 ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-[(2-methyl-3-nitrobenzoyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.