TL;DR: 2-Imino-3-(4-phenyl-1,3-thiazol-2-yl)-1,3-thiazolidin-4-one (CAS 131213-50-8) 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.
2-imino-3-(4-phenyl-1,3-thiazol-2-yl)-1,3-thiazolidin-4-one
Also Known As: BAS 03450491, 2'-Imino-4-phenyl-[2,3']bithiazolyl-4'-one, 2-imino-3-(4-phenyl-1,3-thiazol-2-yl)-1,3-thiazolidin-4-one, 2-Imino-3-(4-phenylthiazol-2-yl)thiazolidin-4-one
| Molecular Formula | C12H9N3OS2 |
| Molecular Weight | 275.0187 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 275.0187 Da |
| Heavy Atoms | 18 |
| Complexity | 357.0 |
| SMILES | C1C(=O)N(C(=N)S1)C2=NC(=CS2)C3=CC=CC=C3 |
| InChIKey | MGUQDEVACYUXKA-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Imino-3-(4-phenyl-1,3-thiazol-2-yl)-1,3-thiazolidin-4-one. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Imino-3-(4-phenyl-1,3-thiazol-2-yl)-1,3-thiazolidin-4-one. Following Lipinski's Rule of Five, 2-Imino-3-(4-phenyl-1,3-thiazol-2-yl)-1,3-thiazolidin-4-one 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 2-Imino-3-(4-phenyl-1,3-thiazol-2-yl)-1,3-thiazolidin-4-one is 131213-50-8.
The molecular formula of 2-Imino-3-(4-phenyl-1,3-thiazol-2-yl)-1,3-thiazolidin-4-one is C12H9N3OS2.
The molecular weight of 2-Imino-3-(4-phenyl-1,3-thiazol-2-yl)-1,3-thiazolidin-4-one is 275.0187 g/mol.
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