TL;DR: 1,3,4-Oxadiazole-2(3H)-thione, 5-(2-methyl-5-phenyl-4-thiazolyl)- (CAS 143539-25-7) is a chemical compound with molecular formula C12H9N3OS2 and molecular weight 275.0187 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(2-methyl-5-phenyl-1,3-thiazol-4-yl)-3H-1,3,4-oxadiazole-2-thione
Also Known As: 5-(2-methyl-5-phenylthiazol-4-yl)-1,3,4-oxadiazole-2(3H)-thione, 1,3,4-Oxadiazole-2(3H)-thione, 5-(2-methyl-5-phenyl-4-thiazolyl)-, 5-(2-Methyl-5-phenyl-1,3-thiazol-4-yl)-1,3,4-oxadiazole-2(3H)-thione, 5-(2-methyl-5-phenyl-1,3-thiazol-4-yl)-3H-1,3,4-oxadiazole-2-thione, 5-(2-methyl-5-phenyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl hydrosulfide
| Molecular Formula | C12H9N3OS2 |
| Molecular Weight | 275.0187 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 275.0187 Da |
| Heavy Atoms | 18 |
| Complexity | 368.0 |
| SMILES | CC1=NC(=C(S1)C2=CC=CC=C2)C3=NNC(=S)O3 |
| InChIKey | JCEDQFMMFXFDMF-UHFFFAOYSA-N |
The XLogP value of 3.5 indicates that 1,3,4-Oxadiazole-2(3H)-thione, 5-(2-methyl-5-phenyl-4-thiazolyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,4-Oxadiazole-2(3H)-thione, 5-(2-methyl-5-phenyl-4-thiazolyl)-. Following Lipinski's Rule of Five, 1,3,4-Oxadiazole-2(3H)-thione, 5-(2-methyl-5-phenyl-4-thiazolyl)- has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,3,4-Oxadiazole-2(3H)-thione, 5-(2-methyl-5-phenyl-4-thiazolyl)- is 143539-25-7.
The molecular formula of 1,3,4-Oxadiazole-2(3H)-thione, 5-(2-methyl-5-phenyl-4-thiazolyl)- is C12H9N3OS2.
The molecular weight of 1,3,4-Oxadiazole-2(3H)-thione, 5-(2-methyl-5-phenyl-4-thiazolyl)- is 275.0187 g/mol.
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