Banthine chloride
TL;DR: Banthine chloride (CAS 63957-56-2) is a chemical compound with molecular formula C21H26ClNO3 and molecular weight 375.16013 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diethyl-methyl-[2-(9H-xanthene-9-carbonyloxy)ethyl]azanium chloride
Also Known As: Banthine chloride, AMMONIUM, DIETHYL(2-HYDROXYETHYL)METHYL-, CHLORIDE, XANTHENE-9-CARBOXYLATE, diethyl-methyl-[2-(9H-xanthene-9-carbonyloxy)ethyl]azanium chloride, Ethanaminium, N,N-diethyl-N-methyl-2-[(9H-xanthen-9-ylcarbonyl)oxy]-, chloride, N,N-Diethyl-N-methyl-2-[(9H-xanthene-9-carbonyl)oxy]ethan-1-aminium chloride
Technical Specifications
| Molecular Formula | C21H26ClNO3 |
| Molecular Weight | 375.16013 g/mol |
| XLogP | 0.96 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 375.16013 Da |
| Heavy Atoms | 26 |
| Complexity | 426.0 |
| SMILES | CC[N+](C)(CC)CCOC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13.[Cl-] |
| InChIKey | WPWZGEGFOHKFHG-UHFFFAOYSA-M |
Chemical Property Profile of Banthine chloride
Property Insights of Banthine chloride
The XLogP value of 0.96 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Banthine chloride. With a topological polar surface area (TPSA) of 35.5 Ų, Banthine chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Banthine chloride has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Banthine chloride?
The CAS number of Banthine chloride is 63957-56-2.
What is the molecular formula of Banthine chloride?
The molecular formula of Banthine chloride is C21H26ClNO3.
What is the molecular weight of Banthine chloride?
The molecular weight of Banthine chloride is 375.16013 g/mol.
Where can I buy Banthine chloride?
You can request a quote for Banthine chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Banthine chloride?
Yes, CoreyChem provides custom synthesis services for Banthine chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.