TL;DR: 2-Decenoic acid N-acetylcysteamine thioester (CAS 15493-41-1) is a chemical compound with molecular formula C14H25NO2S and molecular weight 271.1606 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
S-(2-acetamidoethyl) (E)-dec-2-enethioate
Also Known As: 2-Decenoic-nacs, 2-Decenoic acid N-acetylcysteamine thioester, S-(2-acetamidoethyl) (E)-dec-2-enethioate, 2-Decenethioic acid, S-(2-(acetylamino)ethyl) ester, 2-Decenethioic acid,S-(2-(acetylamino)ethyl) ester
| Molecular Formula | C14H25NO2S |
| Molecular Weight | 271.1606 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 71.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 271.1606 Da |
| Heavy Atoms | 18 |
| Complexity | 265.0 |
| SMILES | CCCCCCC/C=C/C(=O)SCCNC(=O)C |
| InChIKey | HYDKTIAWESXLEF-MDZDMXLPSA-N |
The XLogP value of 3.9 indicates that 2-Decenoic acid N-acetylcysteamine thioester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Decenoic acid N-acetylcysteamine thioester. Following Lipinski's Rule of Five, 2-Decenoic acid N-acetylcysteamine thioester has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Decenoic acid N-acetylcysteamine thioester is 15493-41-1.
The molecular formula of 2-Decenoic acid N-acetylcysteamine thioester is C14H25NO2S.
The molecular weight of 2-Decenoic acid N-acetylcysteamine thioester is 271.1606 g/mol.
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