TL;DR: 4-Methyl-2-propionylamino-thiazole-5-carboxylic acid (CAS 878668-30-5) is a chemical compound with molecular formula C8H10N2O3S and molecular weight 214.04121 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-2-(propanoylamino)-1,3-thiazole-5-carboxylic acid
Also Known As: ASN 09626984, 4-Methyl-2-propionylamino-thiazole-5-carboxylic acid, 4-Methyl-2-(propanoylamino)thiazole-5-carboxylic acid, 4-Methyl-2-[(1-oxopropyl)amino]-5-thiazolecarboxylic acid, 4-methyl-2-(propanoylamino)-1,3-thiazole-5-carboxylic acid
| Molecular Formula | C8H10N2O3S |
| Molecular Weight | 214.04121 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 108.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 214.04121 Da |
| Heavy Atoms | 14 |
| Complexity | 247.0 |
| SMILES | CCC(=O)NC1=NC(=C(S1)C(=O)O)C |
| InChIKey | CTHFDJZDFNISOV-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-2-propionylamino-thiazole-5-carboxylic acid. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-2-propionylamino-thiazole-5-carboxylic acid. Following Lipinski's Rule of Five, 4-Methyl-2-propionylamino-thiazole-5-carboxylic acid has 2 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 4-Methyl-2-propionylamino-thiazole-5-carboxylic acid is 878668-30-5.
The molecular formula of 4-Methyl-2-propionylamino-thiazole-5-carboxylic acid is C8H10N2O3S.
The molecular weight of 4-Methyl-2-propionylamino-thiazole-5-carboxylic acid is 214.04121 g/mol.
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