TL;DR: (3R)-5-oxo-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxylic acid (CAS 1212467-62-3) is a chemical compound with molecular formula C11H9NO3S and molecular weight 235.03032 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R)-5-oxo-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxylic acid
Also Known As: (3R)-5-oxo-2H,3H,5H,9bH-[1,3]thiazolo[2,3-a]isoindole-3-carboxylic acid, (3R)-5-oxo-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxylic acid, (3R)-5-oxo-2H,3H,5H,9bH-[1,3]thiazolo[2,3-a]isoindole-3-carboxylicacid, (3R)-5-oxo-2H,3H,5H,9bH-1,3thiazolo2,3-aisoindole-3-carboxylic acid, (3R)-5-oxo-3,9b-dihydro-2H-thiazolo[2,3-a]isoindole-3-carboxylic acid
| Molecular Formula | C11H9NO3S |
| Molecular Weight | 235.03032 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 82.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 235.03032 Da |
| Heavy Atoms | 16 |
| Complexity | 346.0 |
| SMILES | C1[C@H](N2C(S1)C3=CC=CC=C3C2=O)C(=O)O |
| InChIKey | IXPPKDOOVXQPGI-PEHGTWAWSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3R)-5-oxo-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxylic acid. The TPSA of 82.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (3R)-5-oxo-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxylic acid. Following Lipinski's Rule of Five, (3R)-5-oxo-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-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 (3R)-5-oxo-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxylic acid is 1212467-62-3.
The molecular formula of (3R)-5-oxo-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxylic acid is C11H9NO3S.
The molecular weight of (3R)-5-oxo-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxylic acid is 235.03032 g/mol.
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