TL;DR: Batanopride Hydrochloride (CAS 102670-59-7) is a chemical compound with molecular formula C17H27Cl2N3O3 and molecular weight 391.14294 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-(3-oxobutan-2-yloxy)benzamide;hydrochloride
Also Known As: Batanopride HCl, BATANOPRIDE HYDROCHLORIDE, BATANOPRIDE, BMY-25801 free base, Batanopride hydrochloride [USAN]
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C17H27Cl2N3O3 |
| Molecular Weight | 391.14294 g/mol |
| XLogP | 2.77 |
| Topological Polar Surface Area (TPSA) | 84.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 391.14294 Da |
| Heavy Atoms | 25 |
| Complexity | 418.0 |
| SMILES | CCN(CC)CCNC(=O)C1=CC(=C(C=C1OC(C)C(=O)C)N)Cl.Cl |
| InChIKey | CUTCEGXKJDBAFQ-UHFFFAOYSA-N |
The XLogP value of 2.77 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Batanopride Hydrochloride. The TPSA of 84.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Batanopride Hydrochloride. Following Lipinski's Rule of Five, Batanopride Hydrochloride has 3 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 Batanopride Hydrochloride is 102670-59-7.
The molecular formula of Batanopride Hydrochloride is C17H27Cl2N3O3.
The molecular weight of Batanopride Hydrochloride is 391.14294 g/mol.
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