TL;DR: 2-((2-Hydroxyphenoxy)methyl)-3-(2-(acetylthio)acetyl)-1,3-thiazolidine (CAS 103195-85-3) is a chemical compound with molecular formula C14H17NO4S2 and molecular weight 327.0599 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
S-[2-[2-[(2-hydroxyphenoxy)methyl]-1,3-thiazolidin-3-yl]-2-oxoethyl] ethanethioate
Also Known As: 2-((2-Hydroxyphenoxy)methyl)-3-(2-(acetylthio)acetyl)-1,3-thiazolidine, Ethanethioic acid, S-(2-(2-((2-hydroxyphenoxy)methyl)-3-thiazolidinyl)-2-oxoethyl) ester, S-[2-[2-[(2-hydroxyphenoxy)methyl]-1,3-thiazolidin-3-yl]-2-oxoethyl] ethanethioate, ethyl 8-amino-2,3-dihydro-1,4-benzodioxine-5-carboxylate, 2-acetylsulfanyl-1-[2-[(2-hydroxyphenoxy)methyl]thiazolidin-3-yl]ethan one
| Molecular Formula | C14H17NO4S2 |
| Molecular Weight | 327.0599 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 117.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 327.0599 Da |
| Heavy Atoms | 21 |
| Complexity | 380.0 |
| SMILES | CC(=O)SCC(=O)N1CCSC1COC2=CC=CC=C2O |
| InChIKey | NDRCGGAIKQESQF-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((2-Hydroxyphenoxy)methyl)-3-(2-(acetylthio)acetyl)-1,3-thiazolidine. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((2-Hydroxyphenoxy)methyl)-3-(2-(acetylthio)acetyl)-1,3-thiazolidine. Following Lipinski's Rule of Five, 2-((2-Hydroxyphenoxy)methyl)-3-(2-(acetylthio)acetyl)-1,3-thiazolidine has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-((2-Hydroxyphenoxy)methyl)-3-(2-(acetylthio)acetyl)-1,3-thiazolidine is 103195-85-3.
The molecular formula of 2-((2-Hydroxyphenoxy)methyl)-3-(2-(acetylthio)acetyl)-1,3-thiazolidine is C14H17NO4S2.
The molecular weight of 2-((2-Hydroxyphenoxy)methyl)-3-(2-(acetylthio)acetyl)-1,3-thiazolidine is 327.0599 g/mol.
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