TL;DR: [2-[(2-Fluorophenyl)methylamino]-2-oxoethyl] thiophene-2-carboxylate (CAS 1524717-02-9) is a chemical compound with molecular formula C14H12FNO3S and molecular weight 293.0522 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[(2-fluorophenyl)methylamino]-2-oxoethyl] thiophene-2-carboxylate
Also Known As: 2-((2-fluorobenzyl)amino)-2-oxoethyl thiophene-2-carboxylate, [2-[(2-fluorophenyl)methylamino]-2-oxoethyl] thiophene-2-carboxylate, {[(2-FLUOROPHENYL)METHYL]CARBAMOYL}METHYL THIOPHENE-2-CARBOXYLATE, F6609-3569, 2-[(2-fluorobenzyl)amino]-2-oxoethyl thiophene-2-carboxylate
| Molecular Formula | C14H12FNO3S |
| Molecular Weight | 293.0522 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 293.0522 Da |
| Heavy Atoms | 20 |
| Complexity | 353.0 |
| SMILES | C1=CC=C(C(=C1)CNC(=O)COC(=O)C2=CC=CS2)F |
| InChIKey | RXKHSSYYWZBJFV-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-[(2-Fluorophenyl)methylamino]-2-oxoethyl] thiophene-2-carboxylate. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-[(2-Fluorophenyl)methylamino]-2-oxoethyl] thiophene-2-carboxylate. Following Lipinski's Rule of Five, [2-[(2-Fluorophenyl)methylamino]-2-oxoethyl] thiophene-2-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of [2-[(2-Fluorophenyl)methylamino]-2-oxoethyl] thiophene-2-carboxylate is 1524717-02-9.
The molecular formula of [2-[(2-Fluorophenyl)methylamino]-2-oxoethyl] thiophene-2-carboxylate is C14H12FNO3S.
The molecular weight of [2-[(2-Fluorophenyl)methylamino]-2-oxoethyl] thiophene-2-carboxylate is 293.0522 g/mol.
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