TL;DR: (3S)-1-methyl-3-(9H-thioxanthen-9-ylmethyl)piperidine (CAS 115511-20-1) is a chemical compound with molecular formula C20H23NS and molecular weight 309.15512 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-1-methyl-3-(9H-thioxanthen-9-ylmethyl)piperidine
Also Known As: (S)-Methixene, Methixart, Metixene, Methixene, (S)-, Metixene, (S)-
| Molecular Formula | C20H23NS |
| Molecular Weight | 309.15512 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 28.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 309.15512 Da |
| Heavy Atoms | 22 |
| Complexity | 349.0 |
| SMILES | CN1CCC[C@H](C1)CC2C3=CC=CC=C3SC4=CC=CC=C24 |
| InChIKey | MJFJKKXQDNNUJF-HNNXBMFYSA-N |
The XLogP value of 4.9 indicates that (3S)-1-methyl-3-(9H-thioxanthen-9-ylmethyl)piperidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.5 Ų, (3S)-1-methyl-3-(9H-thioxanthen-9-ylmethyl)piperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3S)-1-methyl-3-(9H-thioxanthen-9-ylmethyl)piperidine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (3S)-1-methyl-3-(9H-thioxanthen-9-ylmethyl)piperidine is 115511-20-1.
The molecular formula of (3S)-1-methyl-3-(9H-thioxanthen-9-ylmethyl)piperidine is C20H23NS.
The molecular weight of (3S)-1-methyl-3-(9H-thioxanthen-9-ylmethyl)piperidine is 309.15512 g/mol.
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