TL;DR: Ethyl 2-(acetylamino)-5-ethylthiophene-3-carboxylate (CAS 13130-38-6) is a chemical compound with molecular formula C11H15NO3S and molecular weight 241.07727 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-acetamido-5-ethylthiophene-3-carboxylate
Also Known As: ethyl 2-acetamido-5-ethylthiophene-3-carboxylate, ethyl 2-(acetylamino)-5-ethylthiophene-3-carboxylate, ETHYL 2-ACETAMIDO-5-ETHYL-THIOPHENE-3-CARBOXYLATE, Ethyl2-(acetylamino)-5-ethylthiophene-3-carboxylate, ethyl 2-(acetylamino)-5-ethyl-3-thiophenecarboxylate
| Molecular Formula | C11H15NO3S |
| Molecular Weight | 241.07727 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 241.07727 Da |
| Heavy Atoms | 16 |
| Complexity | 270.0 |
| SMILES | CCC1=CC(=C(S1)NC(=O)C)C(=O)OCC |
| InChIKey | JDYPHTNMKBGGLI-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(acetylamino)-5-ethylthiophene-3-carboxylate. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(acetylamino)-5-ethylthiophene-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-(acetylamino)-5-ethylthiophene-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 Ethyl 2-(acetylamino)-5-ethylthiophene-3-carboxylate is 13130-38-6.
The molecular formula of Ethyl 2-(acetylamino)-5-ethylthiophene-3-carboxylate is C11H15NO3S.
The molecular weight of Ethyl 2-(acetylamino)-5-ethylthiophene-3-carboxylate is 241.07727 g/mol.
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