TL;DR: 3-(4-Methoxybenzoyl)-1,3-thiazolidine-2-thione (CAS 134821-22-0) is a chemical compound with molecular formula C11H11NO2S2 and molecular weight 253.02312 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-methoxyphenyl)-(2-sulfanylidene-1,3-thiazolidin-3-yl)methanone
Also Known As: 3-(4-methoxybenzoyl)-1,3-thiazolidine-2-thione, BAS 04280482, (4-Methoxyphenyl)(2-thioxothiazolidin-3-yl)methanone, (4-methoxyphenyl)-(2-sulfanylidene-1,3-thiazolidin-3-yl)methanone, (4-Methoxyphenyl)(2-thioxo-3-thiazolidinyl)methanone
| Molecular Formula | C11H11NO2S2 |
| Molecular Weight | 253.02312 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 86.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.02312 Da |
| Heavy Atoms | 16 |
| Complexity | 288.0 |
| SMILES | COC1=CC=C(C=C1)C(=O)N2CCSC2=S |
| InChIKey | PRVIBPPECORITJ-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Methoxybenzoyl)-1,3-thiazolidine-2-thione. The TPSA of 86.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Methoxybenzoyl)-1,3-thiazolidine-2-thione. Following Lipinski's Rule of Five, 3-(4-Methoxybenzoyl)-1,3-thiazolidine-2-thione has 0 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 3-(4-Methoxybenzoyl)-1,3-thiazolidine-2-thione is 134821-22-0.
The molecular formula of 3-(4-Methoxybenzoyl)-1,3-thiazolidine-2-thione is C11H11NO2S2.
The molecular weight of 3-(4-Methoxybenzoyl)-1,3-thiazolidine-2-thione is 253.02312 g/mol.
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