TL;DR: Troquidazole (CAS 108001-60-1) is a chemical compound with molecular formula C14H15N5O3 and molecular weight 301.1175 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N'-(3-nitroquinolin-4-yl)morpholine-4-carboximidamide
Also Known As: Troquidazole, Troquidazol, Troquidazolum, Troquidazole [INN], Troquidazol [INN-Spanish]
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C14H15N5O3 |
| Molecular Weight | 301.1175 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 301.1175 Da |
| Heavy Atoms | 22 |
| Complexity | 433.0 |
| SMILES | C1COCCN1C(=NC2=C(C=NC3=CC=CC=C32)[N+](=O)[O-])N |
| InChIKey | UUJSXEHRMRPYEX-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Troquidazole. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Troquidazole. Following Lipinski's Rule of Five, Troquidazole has 1 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 Troquidazole is 108001-60-1.
The molecular formula of Troquidazole is C14H15N5O3.
The molecular weight of Troquidazole is 301.1175 g/mol.
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