TL;DR: 5-Oxo-hexahydropyrrolo[2,1-b][1,3]thiazole-7a-carboxylic acid (CAS 155796-08-0) is a chemical compound with molecular formula C7H9NO3S and molecular weight 187.03032 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-7a-carboxylic acid
Also Known As: 5-Oxo-hexahydropyrrolo[2,1-b][1,3]thiazole-7a-carboxylic acid, 5-Oxotetrahydropyrrolo[2,1-b]thiazole-7a(5H)-carboxylic acid, 5-oxotetrahydropyrrolo[2,1-b][1,3]thiazole-7a(5H)-carboxylic acid, 5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-7a-carboxylic acid, F2124-0575
| Molecular Formula | C7H9NO3S |
| Molecular Weight | 187.03032 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 82.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 187.03032 Da |
| Heavy Atoms | 12 |
| Complexity | 255.0 |
| SMILES | C1CC2(N(C1=O)CCS2)C(=O)O |
| InChIKey | KUQNZOVOMLCCNA-UHFFFAOYSA-N |
The XLogP value of -0.2 indicates that 5-Oxo-hexahydropyrrolo[2,1-b][1,3]thiazole-7a-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 82.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Oxo-hexahydropyrrolo[2,1-b][1,3]thiazole-7a-carboxylic acid. Following Lipinski's Rule of Five, 5-Oxo-hexahydropyrrolo[2,1-b][1,3]thiazole-7a-carboxylic acid has 1 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 5-Oxo-hexahydropyrrolo[2,1-b][1,3]thiazole-7a-carboxylic acid is 155796-08-0.
The molecular formula of 5-Oxo-hexahydropyrrolo[2,1-b][1,3]thiazole-7a-carboxylic acid is C7H9NO3S.
The molecular weight of 5-Oxo-hexahydropyrrolo[2,1-b][1,3]thiazole-7a-carboxylic acid is 187.03032 g/mol.
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