Alosetron
TL;DR: Alosetron (CAS 122852-42-0) is a chemical compound with molecular formula C17H18N4O and molecular weight 294.14807 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-methyl-2-[(5-methyl-1H-imidazol-4-yl)methyl]-3,4-dihydropyrido[4,3-b]indol-1-one
Also Known As: alosetron, Lotronex, Alosetron HCl, alosetronum, Alosetrone
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H18N4O |
| Molecular Weight | 294.14807 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 53.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.14807 Da |
| Heavy Atoms | 22 |
| Complexity | 442.0 |
| Solubility | 4.38e-01 g/L |
| SMILES | CC1=C(N=CN1)CN2CCC3=C(C2=O)C4=CC=CC=C4N3C |
| InChIKey | JSWZEAMFRNKZNL-UHFFFAOYSA-N |
Chemical Property Profile of Alosetron
Property Insights of Alosetron
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Alosetron. With a topological polar surface area (TPSA) of 53.9 Ų, Alosetron exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Alosetron has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Alosetron?
The CAS number of Alosetron is 122852-42-0.
What is the molecular formula of Alosetron?
The molecular formula of Alosetron is C17H18N4O.
What is the molecular weight of Alosetron?
The molecular weight of Alosetron is 294.14807 g/mol.
Where can I buy Alosetron?
You can request a quote for Alosetron directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Alosetron?
Yes, CoreyChem provides custom synthesis services for Alosetron and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.