TL;DR: 1H-Imidazole, 1-[phenyl(1-phenyl-1H-pyrrol-3-yl)methyl]- (CAS 146673-99-6) is a chemical compound with molecular formula C20H17N3 and molecular weight 299.14224 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[phenyl-(1-phenylpyrrol-3-yl)methyl]imidazole
Also Known As: Methyl 2-aminonicotinate, 1H-Imidazole, 1-[phenyl(1-phenyl-1H-pyrrol-3-yl)methyl]-, 1-[phenyl-(1-phenylpyrrol-3-yl)methyl]imidazole, 1-(phenyl(1-phenyl-1h-pyrrol-3-yl)methyl)-1h imidazole, 1-[Phenyl(1-phenyl-1H-pyrrol-3-yl)methyl]-1H-imidazole
| Molecular Formula | C20H17N3 |
| Molecular Weight | 299.14224 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 22.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.14224 Da |
| Heavy Atoms | 23 |
| Complexity | 360.0 |
| SMILES | C1=CC=C(C=C1)C(C2=CN(C=C2)C3=CC=CC=C3)N4C=CN=C4 |
| InChIKey | YXTSXRAOMZGEAR-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that 1H-Imidazole, 1-[phenyl(1-phenyl-1H-pyrrol-3-yl)methyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.8 Ų, 1H-Imidazole, 1-[phenyl(1-phenyl-1H-pyrrol-3-yl)methyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Imidazole, 1-[phenyl(1-phenyl-1H-pyrrol-3-yl)methyl]- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1H-Imidazole, 1-[phenyl(1-phenyl-1H-pyrrol-3-yl)methyl]- is 146673-99-6.
The molecular formula of 1H-Imidazole, 1-[phenyl(1-phenyl-1H-pyrrol-3-yl)methyl]- is C20H17N3.
The molecular weight of 1H-Imidazole, 1-[phenyl(1-phenyl-1H-pyrrol-3-yl)methyl]- is 299.14224 g/mol.
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