TL;DR: 2-(1H-benzimidazol-2-yl)-1-(4-fluorophenyl)ethanamine (CAS 1279219-44-1) is a chemical compound with molecular formula C15H14FN3 and molecular weight 255.11717 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1H-benzimidazol-2-yl)-1-(4-fluorophenyl)ethanamine
Also Known As: 2-(1H-benzimidazol-2-yl)-1-(4-fluorophenyl)ethanamine, 2-benzimidazol-2-yl-1-(4-fluorophenyl)ethylamine, 2-(1H-1,3-benzodiazol-2-yl)-1-(4-fluorophenyl)ethan-1-amine, 2-(1H-benzoimidazol-2-yl)-1-(4-fluorophenyl)ethanamine, 2-(1H-1,3-BENZODIAZOL-2-YL)-1-(4-FLUOROPHENYL)ETHANAMINE
| Molecular Formula | C15H14FN3 |
| Molecular Weight | 255.11717 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 54.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 255.11717 Da |
| Heavy Atoms | 19 |
| Complexity | 291.0 |
| SMILES | C1=CC=C2C(=C1)NC(=N2)CC(C3=CC=C(C=C3)F)N |
| InChIKey | RRQOQEWVYYPDPI-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1H-benzimidazol-2-yl)-1-(4-fluorophenyl)ethanamine. With a topological polar surface area (TPSA) of 54.7 Ų, 2-(1H-benzimidazol-2-yl)-1-(4-fluorophenyl)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1H-benzimidazol-2-yl)-1-(4-fluorophenyl)ethanamine has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(1H-benzimidazol-2-yl)-1-(4-fluorophenyl)ethanamine is 1279219-44-1.
The molecular formula of 2-(1H-benzimidazol-2-yl)-1-(4-fluorophenyl)ethanamine is C15H14FN3.
The molecular weight of 2-(1H-benzimidazol-2-yl)-1-(4-fluorophenyl)ethanamine is 255.11717 g/mol.
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