TL;DR: 1-(6-Chloropyridin-2-yl)-1H-pyrazol-5-ol (CAS 1007030-95-6) is a chemical compound with molecular formula C8H6ClN3O and molecular weight 195.01994 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(6-chloro-2-pyridinyl)-1H-pyrazol-3-one
Also Known As: 1-(6-Chloropyridin-2-yl)-1H-pyrazol-5-ol, Bionet2_000012, 2-(6-chloro-2-pyridinyl)-2,4-dihydro-3H-pyrazol-3-one, 2-(6-chloropyridin-2-yl)-1H-pyrazol-3-one, 2-(6-Chloro-Pyridin-2-Yl)-2H-Pyrazol-3-Ol
| Molecular Formula | C8H6ClN3O |
| Molecular Weight | 195.01994 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 45.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 195.01994 Da |
| Heavy Atoms | 13 |
| Complexity | 244.0 |
| SMILES | C1=CC(=NC(=C1)Cl)N2C(=O)C=CN2 |
| InChIKey | HWQKZSUSRSFASO-UHFFFAOYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(6-Chloropyridin-2-yl)-1H-pyrazol-5-ol. With a topological polar surface area (TPSA) of 45.2 Ų, 1-(6-Chloropyridin-2-yl)-1H-pyrazol-5-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(6-Chloropyridin-2-yl)-1H-pyrazol-5-ol has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(6-Chloropyridin-2-yl)-1H-pyrazol-5-ol is 1007030-95-6.
The molecular formula of 1-(6-Chloropyridin-2-yl)-1H-pyrazol-5-ol is C8H6ClN3O.
The molecular weight of 1-(6-Chloropyridin-2-yl)-1H-pyrazol-5-ol is 195.01994 g/mol.
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