TL;DR: (2-ethyl-1-methyl-1H-imidazol-5-yl)(phenyl)methanol (CAS 159859-12-8) is a chemical compound with molecular formula C13H16N2O and molecular weight 216.12627 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-ethyl-3-methylimidazol-4-yl)-phenylmethanol
Also Known As: (2-ethyl-1-methyl-1H-imidazol-5-yl)(phenyl)methanol, BAS 00631781, (2-ethyl-3-methylimidazol-4-yl)-phenylmethanol, BIM-0024669.P001, (2-Ethyl-3-methyl-3H-imidazol-4-yl)-phenyl-methanol
| Molecular Formula | C13H16N2O |
| Molecular Weight | 216.12627 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 38.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.12627 Da |
| Heavy Atoms | 16 |
| Complexity | 216.0 |
| SMILES | CCC1=NC=C(N1C)C(C2=CC=CC=C2)O |
| InChIKey | UAZJDTSAQSFZKG-UHFFFAOYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-ethyl-1-methyl-1H-imidazol-5-yl)(phenyl)methanol. With a topological polar surface area (TPSA) of 38.1 Ų, (2-ethyl-1-methyl-1H-imidazol-5-yl)(phenyl)methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-ethyl-1-methyl-1H-imidazol-5-yl)(phenyl)methanol has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2-ethyl-1-methyl-1H-imidazol-5-yl)(phenyl)methanol is 159859-12-8.
The molecular formula of (2-ethyl-1-methyl-1H-imidazol-5-yl)(phenyl)methanol is C13H16N2O.
The molecular weight of (2-ethyl-1-methyl-1H-imidazol-5-yl)(phenyl)methanol is 216.12627 g/mol.
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