Alosetron Hydrochloride
TL;DR: Alosetron Hydrochloride (CAS 122852-69-1) is a chemical compound with molecular formula C17H19ClN4O and molecular weight 330.12473 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;hydrochloride
Also Known As: ALOSETRON HYDROCHLORIDE, Alosetron HCl, Lotronex, alosetron, Lotrpnex
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H19ClN4O |
| Molecular Weight | 330.12473 g/mol |
| XLogP | 2.83 |
| Topological Polar Surface Area (TPSA) | 53.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 330.12473 Da |
| Heavy Atoms | 23 |
| Complexity | 442.0 |
| Melting Point | 288-291 °C |
| Solubility | White to beige solid with a solubility of 61 mg/ml in water, 42 mg/ml in 0.1M hydrochloric acid, 0.3 mg/ml in pH 6 phosphate buffer, and <0.1 mg/ml in pH 8 phosphate buffer /Hydrochloride/ |
| SMILES | CC1=C(N=CN1)CN2CCC3=C(C2=O)C4=CC=CC=C4N3C.Cl |
| InChIKey | FNYQZOVOVDSGJH-UHFFFAOYSA-N |
Chemical Property Profile of Alosetron Hydrochloride
Property Insights of Alosetron Hydrochloride
The XLogP value of 2.83 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Alosetron Hydrochloride. With a topological polar surface area (TPSA) of 53.9 Ų, Alosetron Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Alosetron Hydrochloride has 2 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 Hydrochloride?
The CAS number of Alosetron Hydrochloride is 122852-69-1.
What is the molecular formula of Alosetron Hydrochloride?
The molecular formula of Alosetron Hydrochloride is C17H19ClN4O.
What is the molecular weight of Alosetron Hydrochloride?
The molecular weight of Alosetron Hydrochloride is 330.12473 g/mol.
Where can I buy Alosetron Hydrochloride?
You can request a quote for Alosetron Hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Alosetron Hydrochloride?
Yes, CoreyChem provides custom synthesis services for Alosetron Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.