TL;DR: 4-[(2-Pyridinylimino)methyl]phenol (CAS 1195868-15-5) is a chemical compound with molecular formula C12H10N2O and molecular weight 198.07932 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(pyridin-2-yliminomethyl)phenol
Also Known As: 4-[(2-pyridinylimino)methyl]phenol, Phenol, 4-[(2-pyridinylimino)methyl]-, 4-[(pyridin-2-ylamino)methylidene]cyclohexa-2,5-dien-1-one
| Molecular Formula | C12H10N2O |
| Molecular Weight | 198.07932 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 45.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.07932 Da |
| Heavy Atoms | 15 |
| Complexity | 210.0 |
| SMILES | C1=CC=NC(=C1)N=CC2=CC=C(C=C2)O |
| InChIKey | KZYKNPLZPSHIHM-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(2-Pyridinylimino)methyl]phenol. With a topological polar surface area (TPSA) of 45.5 Ų, 4-[(2-Pyridinylimino)methyl]phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(2-Pyridinylimino)methyl]phenol 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 4-[(2-Pyridinylimino)methyl]phenol is 1195868-15-5.
The molecular formula of 4-[(2-Pyridinylimino)methyl]phenol is C12H10N2O.
The molecular weight of 4-[(2-Pyridinylimino)methyl]phenol is 198.07932 g/mol.
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