TL;DR: 2-chloro-N-{2-[(4-chlorophenyl)thio]ethyl}acetamide (CAS 104864-59-7) is a chemical compound with molecular formula C10H11Cl2NOS and molecular weight 262.99384 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-N-[2-(4-chlorophenyl)sulfanylethyl]acetamide
Also Known As: 2-chloro-N-{2-[(4-chlorophenyl)thio]ethyl}acetamide, (S)-(+)-2-Decanol, 2-chloro-N-{2-[(4-chlorophenyl)sulfanyl]ethyl}acetamide, 2-chloro-N-[2-(4-chlorophenyl)sulfanylethyl]acetamide, 2-Benzyloxy-N-methoxy-N-methyl-acetamide
| Molecular Formula | C10H11Cl2NOS |
| Molecular Weight | 262.99384 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 262.99384 Da |
| Heavy Atoms | 15 |
| Complexity | 196.0 |
| SMILES | C1=CC(=CC=C1SCCNC(=O)CCl)Cl |
| InChIKey | DWJLPYPCRJRTDG-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that 2-chloro-N-{2-[(4-chlorophenyl)thio]ethyl}acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 2-chloro-N-{2-[(4-chlorophenyl)thio]ethyl}acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-{2-[(4-chlorophenyl)thio]ethyl}acetamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-chloro-N-{2-[(4-chlorophenyl)thio]ethyl}acetamide is 104864-59-7.
The molecular formula of 2-chloro-N-{2-[(4-chlorophenyl)thio]ethyl}acetamide is C10H11Cl2NOS.
The molecular weight of 2-chloro-N-{2-[(4-chlorophenyl)thio]ethyl}acetamide is 262.99384 g/mol.
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