TL;DR: Mazaticol (CAS 42024-98-6) is a chemical compound with molecular formula C21H27NO3S2 and molecular weight 405.14325 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6,6,9-trimethyl-9-azabicyclo[3.3.1]nonan-3-yl) 2-hydroxy-2,2-dithiophen-2-ylacetate
Also Known As: Mazaticol, Mazaticolum, Pentona, Mazaticol HCl, Mazaticol [INN]
| Molecular Formula | C21H27NO3S2 |
| Molecular Weight | 405.14325 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 405.14325 Da |
| Heavy Atoms | 27 |
| Complexity | 554.0 |
| SMILES | CC1(CCC2CC(CC1N2C)OC(=O)C(C3=CC=CS3)(C4=CC=CS4)O)C |
| InChIKey | AMHPTVWBZSYFSS-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that Mazaticol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Mazaticol. Following Lipinski's Rule of Five, Mazaticol has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Mazaticol is 42024-98-6.
The molecular formula of Mazaticol is C21H27NO3S2.
The molecular weight of Mazaticol is 405.14325 g/mol.
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