Triclabendazole sulfoxide
TL;DR: Triclabendazole sulfoxide (CAS 100648-13-3) is a chemical compound with molecular formula C14H9Cl3N2O2S and molecular weight 373.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-5-(2,3-dichlorophenoxy)-2-methylsulfinyl-1H-benzimidazole
Also Known As: Triclabendazole sulfoxide, Tcbz-SX, Octreotide, Hydroxy Triclabendazole, TCBZ-SO
| Molecular Formula | C14H9Cl3N2O2S |
|---|---|
| Molecular Weight | 373.95 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 74.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 373.94504 |
| Heavy Atoms | 22 |
| Complexity | 431.0 |
Chemical Identifiers
| CAS Number | 100648-13-3 |
|---|---|
| SMILES | CS(=O)C1=NC2=CC(=C(C=C2N1)Cl)OC3=C(C(=CC=C3)Cl)Cl |
| InChIKey | GABQPFWIQFRJSE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Triclabendazole sulfoxide (CAS 100648-13-3), with molecular formula C14H9Cl3N2O2S and molecular weight 373.95 g/mol. IUPAC: 6-chloro-5-(2,3-dichlorophenoxy)-2-methylsulfinyl-1H-benzimidazole.
Chemical Property Profile of Triclabendazole sulfoxide
Property Insights of Triclabendazole sulfoxide
The XLogP value of 4.4 indicates that Triclabendazole sulfoxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Triclabendazole sulfoxide. Following Lipinski's Rule of Five, Triclabendazole sulfoxide has 1 hydrogen bond donor(s) and 4 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 Triclabendazole sulfoxide?
The CAS number of Triclabendazole sulfoxide is 100648-13-3.
What is the molecular formula of Triclabendazole sulfoxide?
The molecular formula of Triclabendazole sulfoxide is C14H9Cl3N2O2S.
What is the molecular weight of Triclabendazole sulfoxide?
The molecular weight of Triclabendazole sulfoxide is 373.95 g/mol.
Where can I buy Triclabendazole sulfoxide?
You can request a quote for Triclabendazole sulfoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triclabendazole sulfoxide?
Yes, KEHONG BIO provides custom synthesis services for Triclabendazole sulfoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.