TL;DR: Ruzadolane (CAS 115762-17-9) is a chemical compound with molecular formula C18H19F2N5S and molecular weight 375.13293 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2-[4-(2,4-difluorophenyl)piperazin-1-yl]ethylsulfanyl]-[1,2,4]triazolo[4,3-a]pyridine
Also Known As: Ruzadolane, ruzadolano, ruzadolanum, Ruzadolane [INN], UP 26-91
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C18H19F2N5S |
| Molecular Weight | 375.13293 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 62.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 375.13293 Da |
| Heavy Atoms | 26 |
| Complexity | 451.0 |
| SMILES | C1CN(CCN1CCSC2=NN=C3N2C=CC=C3)C4=C(C=C(C=C4)F)F |
| InChIKey | LOKBLLCVOKCEFR-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that Ruzadolane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ruzadolane. Following Lipinski's Rule of Five, Ruzadolane has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ruzadolane is 115762-17-9.
The molecular formula of Ruzadolane is C18H19F2N5S.
The molecular weight of Ruzadolane is 375.13293 g/mol.
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