TL;DR: Leflutrozole (CAS 143030-47-1) is a chemical compound with molecular formula C17H10FN5 and molecular weight 303.092 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(4-cyanophenyl)-fluoro-(1,2,4-triazol-1-yl)methyl]benzonitrile
Also Known As: Leflutrozole, leflutrozol, leflutrozolum, Cgp 47645, LEFLUTROZOLE [INN]
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C17H10FN5 |
| Molecular Weight | 303.092 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 78.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 303.092 Da |
| Heavy Atoms | 23 |
| Complexity | 466.0 |
| SMILES | C1=CC(=CC=C1C#N)C(C2=CC=C(C=C2)C#N)(N3C=NC=N3)F |
| InChIKey | PZDLRBUQYWMNBR-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that Leflutrozole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Leflutrozole. Following Lipinski's Rule of Five, Leflutrozole has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Leflutrozole is 143030-47-1.
The molecular formula of Leflutrozole is C17H10FN5.
The molecular weight of Leflutrozole is 303.092 g/mol.
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