TL;DR: [2-(2-Ethylanilino)-2-oxoethyl] 5-bromopyridine-3-carboxylate (CAS 1211123-60-2) is a chemical compound with molecular formula C16H15BrN2O3 and molecular weight 362.0266 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(2-ethylanilino)-2-oxoethyl] 5-bromopyridine-3-carboxylate
Also Known As: [(2-ethylphenyl)carbamoyl]methyl 5-bromopyridine-3-carboxylate|2-((2-ethylphenyl)amino)-2-oxoethyl 5-bromonicotinate|[2-(2-ethylanilino)-2-oxoethyl] 5-bromopyridine-3-carboxylate|F6609-1822|2-[(2-ethylphenyl)amino]-2-oxoethyl 5-bromopyridine-3-carboxylate|STL075380
| Molecular Formula | C16H15BrN2O3 |
| Molecular Weight | 362.0266 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 68.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 362.0266 Da |
| Heavy Atoms | 22 |
| Complexity | 392.0 |
| SMILES | CCC1=CC=CC=C1NC(=O)COC(=O)C2=CC(=CN=C2)Br |
| InChIKey | FUZVFCKLMWMGIE-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that [2-(2-Ethylanilino)-2-oxoethyl] 5-bromopyridine-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(2-Ethylanilino)-2-oxoethyl] 5-bromopyridine-3-carboxylate. Following Lipinski's Rule of Five, [2-(2-Ethylanilino)-2-oxoethyl] 5-bromopyridine-3-carboxylate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of [2-(2-Ethylanilino)-2-oxoethyl] 5-bromopyridine-3-carboxylate is 1211123-60-2.
The molecular formula of [2-(2-Ethylanilino)-2-oxoethyl] 5-bromopyridine-3-carboxylate is C16H15BrN2O3.
The molecular weight of [2-(2-Ethylanilino)-2-oxoethyl] 5-bromopyridine-3-carboxylate is 362.0266 g/mol.
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