TL;DR: Oxaflumazine (CAS 16498-21-8) is a chemical compound with molecular formula C26H32F3N3O2S and molecular weight 507.21674 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
10-[3-[4-[2-(1,3-dioxan-2-yl)ethyl]piperazin-1-yl]propyl]-2-(trifluoromethyl)phenothiazine
Also Known As: Oxaflumazine, Oxaflumazina, Oxaflumazinum, Ossaflumazina, Oxaflumine
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C26H32F3N3O2S |
| Molecular Weight | 507.21674 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 53.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 507.21674 Da |
| Heavy Atoms | 35 |
| Complexity | 658.0 |
| SMILES | C1COC(OC1)CCN2CCN(CC2)CCCN3C4=CC=CC=C4SC5=C3C=C(C=C5)C(F)(F)F |
| InChIKey | GXCXYCOOYDMQOK-UHFFFAOYSA-N |
The XLogP value of 5.4 indicates that Oxaflumazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.5 Ų, Oxaflumazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxaflumazine has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Oxaflumazine is 16498-21-8.
The molecular formula of Oxaflumazine is C26H32F3N3O2S.
The molecular weight of Oxaflumazine is 507.21674 g/mol.
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