TL;DR: Bepiastine (CAS 121041-43-8) is a chemical compound with molecular formula C16H17N3OS and molecular weight 299.10922 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-[2-(dimethylamino)ethyl]pyrido[2,3-b][1,5]benzothiazepin-5-one
Also Known As: Bepiastine, Bepiastinum, Bepiastin, bepiastina, Bepiastine [INN:DCF]
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C16H17N3OS |
| Molecular Weight | 299.10922 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 61.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.10922 Da |
| Heavy Atoms | 21 |
| Complexity | 377.0 |
| SMILES | CN(C)CCN1C2=CC=CC=C2SC3=C(C1=O)C=CC=N3 |
| InChIKey | ZEWJVHFRQFCLFW-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bepiastine. The TPSA of 61.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Bepiastine. Following Lipinski's Rule of Five, Bepiastine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Bepiastine is 121041-43-8.
The molecular formula of Bepiastine is C16H17N3OS.
The molecular weight of Bepiastine is 299.10922 g/mol.
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