TL;DR: Clazuril (CAS 101831-36-1) is a chemical compound with molecular formula C17H10Cl2N4O2 and molecular weight 372.01807 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
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]
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C17H10Cl2N4O2 |
| Molecular Weight | 372.01807 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 85.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 372.01807 Da |
| Heavy Atoms | 25 |
| Complexity | 609.0 |
| 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 |
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.
The CAS number of Clazuril is 101831-36-1.
The molecular formula of Clazuril is C17H10Cl2N4O2.
The molecular weight of Clazuril is 372.01807 g/mol.
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