Fabesetron
TL;DR: Fabesetron (CAS 129299-72-5) is a chemical compound with molecular formula C18H19N3O and molecular weight 293.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7R)-10-methyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one
Also Known As: Fabesetron, fabesetronum, Fabesetron [INN], KST-1A1580, Tox21_113200
| Molecular Formula | C18H19N3O |
|---|---|
| Molecular Weight | 293.15 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 50.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 293.1528 |
| Heavy Atoms | 22 |
| Complexity | 440.0 |
Chemical Identifiers
| CAS Number | 129299-72-5 |
|---|---|
| SMILES | CC1=C2CC[C@@H](C(=O)N2C3=CC=CC=C13)CC4=C(NC=N4)C |
| InChIKey | AEKQMJRJRAHOAP-CYBMUJFWSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Fabesetron (CAS 129299-72-5), with molecular formula C18H19N3O and molecular weight 293.15 g/mol. IUPAC: (7R)-10-methyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one.
Chemical Property Profile of Fabesetron
Property Insights of Fabesetron
The XLogP value of 3.2 indicates that Fabesetron is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.7 Ų, Fabesetron exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Fabesetron 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
Frequently Asked Questions
What is the CAS number of Fabesetron?
The CAS number of Fabesetron is 129299-72-5.
What is the molecular formula of Fabesetron?
The molecular formula of Fabesetron is C18H19N3O.
What is the molecular weight of Fabesetron?
The molecular weight of Fabesetron is 293.15 g/mol.
Where can I buy Fabesetron?
You can request a quote for Fabesetron directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fabesetron?
Yes, KEHONG BIO provides custom synthesis services for Fabesetron and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.