TL;DR: (Z)-6-methyl-2-((5-methylthiophen-2-yl)methylene)-2H-thiazolo[3,2-b][1,2,4]triazine-3,7-dione (CAS 1351358-15-0) is a chemical compound with molecular formula C12H9N3O2S2 and molecular weight 291.0136 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2Z)-6-methyl-2-[(5-methylthiophen-2-yl)methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione
Also Known As: (Z)-6-methyl-2-((5-methylthiophen-2-yl)methylene)-2H-thiazolo[3,2-b][1,2,4]triazine-3,7-dione, (2Z)-6-methyl-2-[(5-methylthiophen-2-yl)methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione, (2Z)-6-methyl-2-[(5-methylthiophen-2-yl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
| Molecular Formula | C12H9N3O2S2 |
| Molecular Weight | 291.0136 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 116.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 291.0136 Da |
| Heavy Atoms | 19 |
| Complexity | 553.0 |
| SMILES | CC1=CC=C(S1)/C=C\2/C(=O)N3C(=NC(=O)C(=N3)C)S2 |
| InChIKey | BLXYJDAZJJEWCW-UITAMQMPSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-6-methyl-2-((5-methylthiophen-2-yl)methylene)-2H-thiazolo[3,2-b][1,2,4]triazine-3,7-dione. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-6-methyl-2-((5-methylthiophen-2-yl)methylene)-2H-thiazolo[3,2-b][1,2,4]triazine-3,7-dione. Following Lipinski's Rule of Five, (Z)-6-methyl-2-((5-methylthiophen-2-yl)methylene)-2H-thiazolo[3,2-b][1,2,4]triazine-3,7-dione has 0 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 (Z)-6-methyl-2-((5-methylthiophen-2-yl)methylene)-2H-thiazolo[3,2-b][1,2,4]triazine-3,7-dione is 1351358-15-0.
The molecular formula of (Z)-6-methyl-2-((5-methylthiophen-2-yl)methylene)-2H-thiazolo[3,2-b][1,2,4]triazine-3,7-dione is C12H9N3O2S2.
The molecular weight of (Z)-6-methyl-2-((5-methylthiophen-2-yl)methylene)-2H-thiazolo[3,2-b][1,2,4]triazine-3,7-dione is 291.0136 g/mol.
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