TL;DR: 3-Cyclohexyl-5-[(4-fluorophenyl)methylene]-2-thioxo-1,3-thiazolidin-4-one (CAS 361476-29-1) is a chemical compound with molecular formula C16H16FNOS2 and molecular weight 321.06573 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5Z)-3-cyclohexyl-5-[(4-fluorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 3-cyclohexyl-5-[(4-fluorophenyl)methylene]-2-thioxo-1,3-thiazolidin-4-one, (Z)-3-cyclohexyl-5-(4-fluorobenzylidene)-2-thioxothiazolidin-4-one, (5Z)-3-cyclohexyl-5-(4-fluorobenzylidene)-2-thioxo-1,3-thiazolidin-4-one, (5Z)-3-cyclohexyl-5-[(4-fluorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C16H16FNOS2 |
| Molecular Weight | 321.06573 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 77.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 321.06573 Da |
| Heavy Atoms | 21 |
| Complexity | 451.0 |
| SMILES | C1CCC(CC1)N2C(=O)/C(=C/C3=CC=C(C=C3)F)/SC2=S |
| InChIKey | SLNFKQZXQNPJER-UVTDQMKNSA-N |
The XLogP value of 4.9 indicates that 3-Cyclohexyl-5-[(4-fluorophenyl)methylene]-2-thioxo-1,3-thiazolidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Cyclohexyl-5-[(4-fluorophenyl)methylene]-2-thioxo-1,3-thiazolidin-4-one. Following Lipinski's Rule of Five, 3-Cyclohexyl-5-[(4-fluorophenyl)methylene]-2-thioxo-1,3-thiazolidin-4-one 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-Cyclohexyl-5-[(4-fluorophenyl)methylene]-2-thioxo-1,3-thiazolidin-4-one is 361476-29-1.
The molecular formula of 3-Cyclohexyl-5-[(4-fluorophenyl)methylene]-2-thioxo-1,3-thiazolidin-4-one is C16H16FNOS2.
The molecular weight of 3-Cyclohexyl-5-[(4-fluorophenyl)methylene]-2-thioxo-1,3-thiazolidin-4-one is 321.06573 g/mol.
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