Luxabendazole
TL;DR: Luxabendazole (CAS 90509-02-7) is a chemical compound with molecular formula C15H12FN3O5S and molecular weight 365.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(methoxycarbonylamino)-3H-benzimidazol-5-yl] 4-fluorobenzenesulfonate
Also Known As: Luxabendazole, Luxabendazolum, Luxabendazol, Luxabendazol [Spanish], Luxabendazolum [Latin]
| Molecular Formula | C15H12FN3O5S |
|---|---|
| Molecular Weight | 365.05 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 365.04816 |
| Heavy Atoms | 25 |
| Complexity | 576.0 |
Chemical Identifiers
| CAS Number | 90509-02-7 |
|---|---|
| SMILES | COC(=O)NC1=NC2=C(N1)C=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)F |
| InChIKey | ZVIDWFUBDDXAJA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Luxabendazole (CAS 90509-02-7), with molecular formula C15H12FN3O5S and molecular weight 365.05 g/mol. IUPAC: [2-(methoxycarbonylamino)-3H-benzimidazol-5-yl] 4-fluorobenzenesulfonate.
Chemical Property Profile of Luxabendazole
Property Insights of Luxabendazole
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Luxabendazole. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Luxabendazole. Following Lipinski's Rule of Five, Luxabendazole has 2 hydrogen bond donor(s) and 7 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 Luxabendazole?
The CAS number of Luxabendazole is 90509-02-7.
What is the molecular formula of Luxabendazole?
The molecular formula of Luxabendazole is C15H12FN3O5S.
What is the molecular weight of Luxabendazole?
The molecular weight of Luxabendazole is 365.05 g/mol.
Where can I buy Luxabendazole?
You can request a quote for Luxabendazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Luxabendazole?
Yes, KEHONG BIO provides custom synthesis services for Luxabendazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.