TL;DR: 2-(Octadec-9-EN-1-YL)-4,5-dihydro-1H-imidazole (CAS 71913-12-7) is a chemical compound with molecular formula C21H40N2 and molecular weight 320.31915 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-octadec-9-enyl-4,5-dihydro-1H-imidazole
Also Known As: 1H-Imidazole,4,5-dihydro-2-(9-octadecen-1-yl)-, 2-(OCTADEC-9-EN-1-YL)-4,5-DIHYDRO-1H-IMIDAZOLE
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C21H40N2 |
| Molecular Weight | 320.31915 g/mol |
| XLogP | 7.2 |
| Topological Polar Surface Area (TPSA) | 24.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 16 |
| Exact Mass | 320.31915 Da |
| Heavy Atoms | 23 |
| Complexity | 307.0 |
| SMILES | CCCCCCCCC=CCCCCCCCCC1=NCCN1 |
| InChIKey | QULUVEPNTKJBMR-UHFFFAOYSA-N |
The XLogP value of 7.2 indicates that 2-(Octadec-9-EN-1-YL)-4,5-dihydro-1H-imidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.4 Ų, 2-(Octadec-9-EN-1-YL)-4,5-dihydro-1H-imidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Octadec-9-EN-1-YL)-4,5-dihydro-1H-imidazole has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-(Octadec-9-EN-1-YL)-4,5-dihydro-1H-imidazole is 71913-12-7.
The molecular formula of 2-(Octadec-9-EN-1-YL)-4,5-dihydro-1H-imidazole is C21H40N2.
The molecular weight of 2-(Octadec-9-EN-1-YL)-4,5-dihydro-1H-imidazole is 320.31915 g/mol.
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