TL;DR: Limazocic (CAS 128620-82-6) is a chemical compound with molecular formula C8H13NO3S2 and molecular weight 235.03369 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4R)-7,7-dimethyl-6-oxo-1,2,5-dithiazocane-4-carboxylic acid
Also Known As: Limazocic, limazocico, Limazocic [INN], limazocicum, Limazocic < Prop INN >
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C8H13NO3S2 |
| Molecular Weight | 235.03369 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 117.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 235.03369 Da |
| Heavy Atoms | 14 |
| Complexity | 255.0 |
| SMILES | CC1(CSSC[C@H](NC1=O)C(=O)O)C |
| InChIKey | PTARWFJHCZHOGS-YFKPBYRVSA-N |
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Limazocic. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Limazocic. Following Lipinski's Rule of Five, Limazocic 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 Limazocic is 128620-82-6.
The molecular formula of Limazocic is C8H13NO3S2.
The molecular weight of Limazocic is 235.03369 g/mol.
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