TL;DR: 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl tetradecanoate (CAS 132367-98-7) is a chemical compound with molecular formula C20H35N3O4 and molecular weight 381.26276 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-methyl-5-nitroimidazol-1-yl)ethyl tetradecanoate
Also Known As: Metronidazole myristate, 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl tetradecanoate, 2-(2-methyl-5-nitroimidazol-1-yl)ethyl tetradecanoate, Tetradecanoic acid, 2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl ester, 1,3,6-trihydroxy-2-methyl-9,10-anthraquinone-3-O-(6?-O-acetyl)-EC-D-glucopyranoside
| Molecular Formula | C20H35N3O4 |
| Molecular Weight | 381.26276 g/mol |
| XLogP | 6.5 |
| Topological Polar Surface Area (TPSA) | 89.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 16 |
| Exact Mass | 381.26276 Da |
| Heavy Atoms | 27 |
| Complexity | 415.0 |
| SMILES | CCCCCCCCCCCCCC(=O)OCCN1C(=NC=C1[N+](=O)[O-])C |
| InChIKey | TZVOJNPVLIAXMB-UHFFFAOYSA-N |
The XLogP value of 6.5 indicates that 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl tetradecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl tetradecanoate. Following Lipinski's Rule of Five, 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl tetradecanoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl tetradecanoate is 132367-98-7.
The molecular formula of 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl tetradecanoate is C20H35N3O4.
The molecular weight of 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl tetradecanoate is 381.26276 g/mol.
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