TL;DR: 4-Chloro-2-[[(2-pyridinylmethyl)imino]methyl]phenol (CAS 1287211-19-1) is a chemical compound with molecular formula C13H11ClN2O and molecular weight 246.05598 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-2-(pyridin-2-ylmethyliminomethyl)phenol
Also Known As: 4-Chloro-2-[[(2-pyridinylmethyl)imino]methyl]phenol, 4-Chloro-2-({[(pyridin-2-yl)methyl]imino}methyl)phenol, 4-chloro-6-[(pyridin-2-ylmethylamino)methylidene]cyclohexa-2,4-dien-1-one
| Molecular Formula | C13H11ClN2O |
| Molecular Weight | 246.05598 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 45.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.05598 Da |
| Heavy Atoms | 17 |
| Complexity | 260.0 |
| SMILES | C1=CC=NC(=C1)CN=CC2=C(C=CC(=C2)Cl)O |
| InChIKey | ARPMHOPNXIPBHU-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-2-[[(2-pyridinylmethyl)imino]methyl]phenol. With a topological polar surface area (TPSA) of 45.5 Ų, 4-Chloro-2-[[(2-pyridinylmethyl)imino]methyl]phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-2-[[(2-pyridinylmethyl)imino]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-Chloro-2-[[(2-pyridinylmethyl)imino]methyl]phenol is 1287211-19-1.
The molecular formula of 4-Chloro-2-[[(2-pyridinylmethyl)imino]methyl]phenol is C13H11ClN2O.
The molecular weight of 4-Chloro-2-[[(2-pyridinylmethyl)imino]methyl]phenol is 246.05598 g/mol.
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