TL;DR: 1-(6-fluoro-2-pyridinyl)-4-(1H-1,2,4-triazol-1-yl)-1H-pyrazol-5-ol (CAS 1007237-14-0) is a chemical compound with molecular formula C10H7FN6O and molecular weight 246.06654 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(6-fluoro-2-pyridinyl)-4-(1,2,4-triazol-1-yl)-1H-pyrazol-3-one
Also Known As: 1-(6-fluoro-2-pyridinyl)-4-(1H-1,2,4-triazol-1-yl)-1H-pyrazol-5-ol, 2-(6-fluoropyridin-2-yl)-4-(1,2,4-triazol-1-yl)-1H-pyrazol-3-one, 1-(6-fluoropyridin-2-yl)-4-(1H-1,2,4-triazol-1-yl)-1H-pyrazol-5-ol, 3T-0820, 2-(6-fluoropyridin-2-yl)-4-(1H-1,2,4-triazol-1-yl)-2,3-dihydro-1H-pyrazol-3-one
| Molecular Formula | C10H7FN6O |
| Molecular Weight | 246.06654 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 75.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 246.06654 Da |
| Heavy Atoms | 18 |
| Complexity | 375.0 |
| SMILES | C1=CC(=NC(=C1)F)N2C(=O)C(=CN2)N3C=NC=N3 |
| InChIKey | JYBZOYOWBNSRLK-UHFFFAOYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(6-fluoro-2-pyridinyl)-4-(1H-1,2,4-triazol-1-yl)-1H-pyrazol-5-ol. The TPSA of 75.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(6-fluoro-2-pyridinyl)-4-(1H-1,2,4-triazol-1-yl)-1H-pyrazol-5-ol. Following Lipinski's Rule of Five, 1-(6-fluoro-2-pyridinyl)-4-(1H-1,2,4-triazol-1-yl)-1H-pyrazol-5-ol has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(6-fluoro-2-pyridinyl)-4-(1H-1,2,4-triazol-1-yl)-1H-pyrazol-5-ol is 1007237-14-0.
The molecular formula of 1-(6-fluoro-2-pyridinyl)-4-(1H-1,2,4-triazol-1-yl)-1H-pyrazol-5-ol is C10H7FN6O.
The molecular weight of 1-(6-fluoro-2-pyridinyl)-4-(1H-1,2,4-triazol-1-yl)-1H-pyrazol-5-ol is 246.06654 g/mol.
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