TL;DR: 1-(2-Hydroxy-3-methoxypropyl)-2-methyl-4-nitroimidazole (CAS 71006-78-5) is a chemical compound with molecular formula C8H13N3O4 and molecular weight 215.0906 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methoxy-3-(2-methyl-4-nitroimidazol-1-yl)propan-2-ol
Also Known As: AM 1 (Pharmaceutical), 1-HMPMNI, AM 1, 1-(2-Hydroxy-3-methoxypropyl)-2-methyl-4-nitroimidazole, 1-methoxy-3-(2-methyl-4-nitro-1h-imidazol-1-yl)propan-2-ol
| Molecular Formula | C8H13N3O4 |
| Molecular Weight | 215.0906 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 93.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 215.0906 Da |
| Heavy Atoms | 15 |
| Complexity | 220.0 |
| SMILES | CC1=NC(=CN1CC(COC)O)[N+](=O)[O-] |
| InChIKey | JXMRDOOWRDWKJG-UHFFFAOYSA-N |
The XLogP value of -0.4 indicates that 1-(2-Hydroxy-3-methoxypropyl)-2-methyl-4-nitroimidazole is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Hydroxy-3-methoxypropyl)-2-methyl-4-nitroimidazole. Following Lipinski's Rule of Five, 1-(2-Hydroxy-3-methoxypropyl)-2-methyl-4-nitroimidazole has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(2-Hydroxy-3-methoxypropyl)-2-methyl-4-nitroimidazole is 71006-78-5.
The molecular formula of 1-(2-Hydroxy-3-methoxypropyl)-2-methyl-4-nitroimidazole is C8H13N3O4.
The molecular weight of 1-(2-Hydroxy-3-methoxypropyl)-2-methyl-4-nitroimidazole is 215.0906 g/mol.
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