TL;DR: N-[2-(Cyclopropylcarbonyl)-1-benzofuran-3-yl]-2-(phenylsulfanyl)acetamide (CAS 309726-09-8) is a chemical compound with molecular formula C20H17NO3S and molecular weight 351.09293 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-(cyclopropanecarbonyl)-1-benzofuran-3-yl]-2-phenylsulfanylacetamide
Also Known As: TimTec1_005722, BAS 02282153, Acetamide, 2-phenylthio-N-(2-cyclopropanoil-3-benzofuryl)-, N-[2-(Cyclopropylcarbonyl)-1-benzofuran-3-yl]-2-(phenylsulfanyl)acetamide, N-(2-(cyclopropanecarbonyl)benzofuran-3-yl)-2-(phenylthio)acetamide
| Molecular Formula | C20H17NO3S |
| Molecular Weight | 351.09293 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 84.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 351.09293 Da |
| Heavy Atoms | 25 |
| Complexity | 501.0 |
| SMILES | C1CC1C(=O)C2=C(C3=CC=CC=C3O2)NC(=O)CSC4=CC=CC=C4 |
| InChIKey | JAIYILUGKXILTP-UHFFFAOYSA-N |
The XLogP value of 4.8 indicates that N-[2-(Cyclopropylcarbonyl)-1-benzofuran-3-yl]-2-(phenylsulfanyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(Cyclopropylcarbonyl)-1-benzofuran-3-yl]-2-(phenylsulfanyl)acetamide. Following Lipinski's Rule of Five, N-[2-(Cyclopropylcarbonyl)-1-benzofuran-3-yl]-2-(phenylsulfanyl)acetamide 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 N-[2-(Cyclopropylcarbonyl)-1-benzofuran-3-yl]-2-(phenylsulfanyl)acetamide is 309726-09-8.
The molecular formula of N-[2-(Cyclopropylcarbonyl)-1-benzofuran-3-yl]-2-(phenylsulfanyl)acetamide is C20H17NO3S.
The molecular weight of N-[2-(Cyclopropylcarbonyl)-1-benzofuran-3-yl]-2-(phenylsulfanyl)acetamide is 351.09293 g/mol.
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