Clazuril
TL;DR: Clazuril (CAS 101831-36-1) is a chemical compound with molecular formula C17H10Cl2N4O2 and molecular weight 372.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-chloro-4-(3,5-dioxo-1,2,4-triazin-2-yl)phenyl]-2-(4-chlorophenyl)acetonitrile
Also Known As: CLAZURIL, Clazurilo, Clazurilum, Clazuril CRS, Clazurilum [Latin]
| Molecular Formula | C17H10Cl2N4O2 |
|---|---|
| Molecular Weight | 372.02 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 85.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 372.01807 |
| Heavy Atoms | 25 |
| Complexity | 609.0 |
Chemical Identifiers
| CAS Number | 101831-36-1 |
|---|---|
| SMILES | C1=CC(=CC=C1C(C#N)C2=C(C=C(C=C2)N3C(=O)NC(=O)C=N3)Cl)Cl |
| InChIKey | QUUTUGLQZLNABV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Clazuril (CAS 101831-36-1), with molecular formula C17H10Cl2N4O2 and molecular weight 372.02 g/mol. IUPAC: 2-[2-chloro-4-(3,5-dioxo-1,2,4-triazin-2-yl)phenyl]-2-(4-chlorophenyl)acetonitrile.
Chemical Property Profile of Clazuril
Property Insights of Clazuril
The XLogP value of 3.4 indicates that Clazuril is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Clazuril. Following Lipinski's Rule of Five, Clazuril 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 Clazuril?
The CAS number of Clazuril is 101831-36-1.
What is the molecular formula of Clazuril?
The molecular formula of Clazuril is C17H10Cl2N4O2.
What is the molecular weight of Clazuril?
The molecular weight of Clazuril is 372.02 g/mol.
Where can I buy Clazuril?
You can request a quote for Clazuril directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Clazuril?
Yes, KEHONG BIO provides custom synthesis services for Clazuril and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.