TL;DR: (4,5-Dihydro-1H-imidazol-2-yl(methyl)hydrazono)(phenyl)acetic acid hydroiodide (CAS 1049978-06-4) is a chemical compound with molecular formula C12H14N4O2 and molecular weight 246.11168 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2Z)-2-[4,5-dihydro-1H-imidazol-2-yl(methyl)hydrazinylidene]-2-phenylacetic acid
Also Known As: (4,5-Dihydro-1H-imidazol-2-yl(methyl)hydrazono)(phenyl)acetic acid hydroiodide, (2Z)-[2-(4,5-Dihydro-1H-imidazol-2-yl)-2-methylhydrazinylidene](phenyl)acetic acid, (2Z)-2-[4,5-dihydro-1H-imidazol-2-yl(methyl)hydrazinylidene]-2-phenylacetic acid, (2Z)-2-[4,5-dihydro-1H-imidazol-2-yl(methyl)hydrazono]-2-phenyl-acetic acid, (I+/-Z)-I+/--[2-(4,5-Dihydro-1H-imidazol-2-yl)-2-methylhydrazinylidene]benzeneacetic acid
| Molecular Formula | C12H14N4O2 |
| Molecular Weight | 246.11168 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 77.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 246.11168 Da |
| Heavy Atoms | 18 |
| Complexity | 372.0 |
| SMILES | CN(C1=NCCN1)/N=C(/C2=CC=CC=C2)\C(=O)O |
| InChIKey | HIVZBGYZUJHJTG-GDNBJRDFSA-N |
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4,5-Dihydro-1H-imidazol-2-yl(methyl)hydrazono)(phenyl)acetic acid hydroiodide. The TPSA of 77.3 Ų falls within the moderate polarity range, balancing permeability and solubility for (4,5-Dihydro-1H-imidazol-2-yl(methyl)hydrazono)(phenyl)acetic acid hydroiodide. Following Lipinski's Rule of Five, (4,5-Dihydro-1H-imidazol-2-yl(methyl)hydrazono)(phenyl)acetic acid hydroiodide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (4,5-Dihydro-1H-imidazol-2-yl(methyl)hydrazono)(phenyl)acetic acid hydroiodide is 1049978-06-4.
The molecular formula of (4,5-Dihydro-1H-imidazol-2-yl(methyl)hydrazono)(phenyl)acetic acid hydroiodide is C12H14N4O2.
The molecular weight of (4,5-Dihydro-1H-imidazol-2-yl(methyl)hydrazono)(phenyl)acetic acid hydroiodide is 246.11168 g/mol.
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