TL;DR: Ziprasidone (CAS 146939-27-7) is a chemical compound with molecular formula C21H21ClN4OS and molecular weight 412.11246 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-6-chloro-1,3-dihydroindol-2-one
Also Known As: Ziprasidone, Geodon, Zeldox, ziprasidona, Zipradon
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C21H21ClN4OS |
| Molecular Weight | 412.11246 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 76.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.11246 Da |
| Heavy Atoms | 28 |
| Complexity | 573.0 |
| Melting Point | >276°C (Ziprasidone Hydrochloride Monohydrate) |
| Flash Point | -2 °C (28 °F) - closed cup |
| Solubility | 7.18e-03 g/L |
| SMILES | C1CN(CCN1CCC2=C(C=C3C(=C2)CC(=O)N3)Cl)C4=NSC5=CC=CC=C54 |
| InChIKey | MVWVFYHBGMAFLY-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that Ziprasidone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Ziprasidone. Following Lipinski's Rule of Five, Ziprasidone has 1 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 Ziprasidone is 146939-27-7.
The molecular formula of Ziprasidone is C21H21ClN4OS.
The molecular weight of Ziprasidone is 412.11246 g/mol.
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