2-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate
TL;DR: 2-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate (CAS 329932-56-1) is a chemical compound with molecular formula C23H17N3O9 and molecular weight 479.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-methoxyphenyl)-2-oxoethyl] 3-[(2,4-dinitrobenzoyl)amino]benzoate
Also Known As: 2-(4-methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate, 2-(4-Methoxyphenyl)-2-oxoethyl 3-[(2,4-dinitrobenzoyl)amino]benzoate, [2-(4-methoxyphenyl)-2-oxoethyl] 3-[(2,4-dinitrobenzoyl)amino]benzoate, 2-(4-METHOXYPHENYL)-2-OXOETHYL 3-(2,4-DINITROBENZAMIDO)BENZOATE, 2-(4-methoxyphenyl)-2-oxoethyl 3-[(2,4-dinitrophenyl)carbonylamino]benzoate
| Molecular Formula | C23H17N3O9 |
|---|---|
| Molecular Weight | 479.10 g/mol |
| LogP | 3.8036 |
| Topological Polar Surface Area | 167.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 479.09647 |
| Heavy Atoms | 35 |
| Complexity | 1320.0673 |
Chemical Identifiers
| CAS Number | 329932-56-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
2-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate (CAS 329932-56-1), with molecular formula C23H17N3O9 and molecular weight 479.10 g/mol. IUPAC: [2-(4-methoxyphenyl)-2-oxoethyl] 3-[(2,4-dinitrobenzoyl)amino]benzoate.
Chemical Property Profile of 2-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate
Property Insights of 2-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate
The XLogP value of 3.8036 indicates that 2-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 167.98 Ų indicates high polarity, suggesting 2-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate has 1 hydrogen bond donor(s) and 9 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-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate?
The CAS number of 2-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate is 329932-56-1.
What is the molecular formula of 2-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate?
The molecular formula of 2-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate is C23H17N3O9.
What is the molecular weight of 2-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate?
The molecular weight of 2-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate is 479.10 g/mol.
Where can I buy 2-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate?
You can request a quote for 2-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methoxyphenyl)-2-oxoethyl 3-({2,4-dinitrobenzoyl}amino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.