TL;DR: 2-Methylspiro[1,3-oxathiolane-5,3'-1-azabicyclo[2.2.2]octane] (CAS 124620-88-8) is a chemical compound with molecular formula C10H17NOS and molecular weight 199.10309 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methylspiro[1,3-oxathiolane-5,3'-1-azabicyclo[2.2.2]octane]
Also Known As: Cevimeline, Evoxac, cevimelina, Cevimeline HCl, Cevimeline hydrochloride
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H17NOS |
| Molecular Weight | 199.10309 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 37.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 199.10309 Da |
| Heavy Atoms | 13 |
| Complexity | 215.0 |
| SMILES | CC1OC2(CN3CCC2CC3)CS1 |
| InChIKey | WUTYZMFRCNBCHQ-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylspiro[1,3-oxathiolane-5,3'-1-azabicyclo[2.2.2]octane]. With a topological polar surface area (TPSA) of 37.8 Ų, 2-Methylspiro[1,3-oxathiolane-5,3'-1-azabicyclo[2.2.2]octane] exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylspiro[1,3-oxathiolane-5,3'-1-azabicyclo[2.2.2]octane] has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Methylspiro[1,3-oxathiolane-5,3'-1-azabicyclo[2.2.2]octane] is 124620-88-8.
The molecular formula of 2-Methylspiro[1,3-oxathiolane-5,3'-1-azabicyclo[2.2.2]octane] is C10H17NOS.
The molecular weight of 2-Methylspiro[1,3-oxathiolane-5,3'-1-azabicyclo[2.2.2]octane] is 199.10309 g/mol.
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