Ricasetron hydrochloride
TL;DR: Ricasetron hydrochloride (CAS 140865-88-9) is a chemical compound with molecular formula C19H28ClN3O and molecular weight 349.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-N-[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]-2H-indole-1-carboxamide;hydrochloride
Also Known As: Ricasetron hydrochloride, Ricasetron HCl, BRL 46470A, BRL-46470A, Brl 46470
| Molecular Formula | C19H28ClN3O |
|---|---|
| Molecular Weight | 349.19 g/mol |
| LogP | 3.5408 |
| Topological Polar Surface Area | 35.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 349.19208 |
| Heavy Atoms | 24 |
| Complexity | 463.0 |
Chemical Identifiers
| CAS Number | 140865-88-9 |
|---|---|
| SMILES | CC1(CN(C2=CC=CC=C21)C(=O)NC3C[C@H]4CC[C@@H](C3)N4C)C.Cl |
| InChIKey | KYQBGUPALRZQEE-XZPOUAKSSA-N |
Product Overview
Ricasetron hydrochloride (CAS 140865-88-9), with molecular formula C19H28ClN3O and molecular weight 349.19 g/mol. IUPAC: 3,3-dimethyl-N-[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]-2H-indole-1-carboxamide;hydrochloride.
Chemical Property Profile of Ricasetron hydrochloride
Property Insights of Ricasetron hydrochloride
The XLogP value of 3.5408 indicates that Ricasetron hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.6 Ų, Ricasetron hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ricasetron 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
Frequently Asked Questions
What is the CAS number of Ricasetron hydrochloride?
The CAS number of Ricasetron hydrochloride is 140865-88-9.
What is the molecular formula of Ricasetron hydrochloride?
The molecular formula of Ricasetron hydrochloride is C19H28ClN3O.
What is the molecular weight of Ricasetron hydrochloride?
The molecular weight of Ricasetron hydrochloride is 349.19 g/mol.
Where can I buy Ricasetron hydrochloride?
You can request a quote for Ricasetron hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ricasetron hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ricasetron hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.