TL;DR: Ethyl 5-methoxy-2-(piperidin-1-ylmethyl)-1-benzofuran-3-carboxylate (CAS 380842-50-2) is a chemical compound with molecular formula C18H23NO4 and molecular weight 317.16272 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 5-methoxy-2-(piperidin-1-ylmethyl)-1-benzofuran-3-carboxylate
Also Known As: IDI1_003459, AH-034/06201008, ethyl 5-methoxy-2-(piperidin-1-ylmethyl)-1-benzofuran-3-carboxylate, Ethyl 5-methoxy-2-(piperidin-1-ylmethyl)benzofuran-3-carboxylate, Ethyl 5-methoxy-2-(1-piperidinylmethyl)-1-benzofuran-3-carboxylate
| Molecular Formula | C18H23NO4 |
| Molecular Weight | 317.16272 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 51.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 317.16272 Da |
| Heavy Atoms | 23 |
| Complexity | 396.0 |
| SMILES | CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC)CN3CCCCC3 |
| InChIKey | GCWVFAKIMDGKKD-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that Ethyl 5-methoxy-2-(piperidin-1-ylmethyl)-1-benzofuran-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.9 Ų, Ethyl 5-methoxy-2-(piperidin-1-ylmethyl)-1-benzofuran-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 5-methoxy-2-(piperidin-1-ylmethyl)-1-benzofuran-3-carboxylate has 0 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 Ethyl 5-methoxy-2-(piperidin-1-ylmethyl)-1-benzofuran-3-carboxylate is 380842-50-2.
The molecular formula of Ethyl 5-methoxy-2-(piperidin-1-ylmethyl)-1-benzofuran-3-carboxylate is C18H23NO4.
The molecular weight of Ethyl 5-methoxy-2-(piperidin-1-ylmethyl)-1-benzofuran-3-carboxylate is 317.16272 g/mol.
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