TL;DR: 3-(1H-Benzoimidazol-2-yl)-acrylic acid (CAS 152935-66-5) is a chemical compound with molecular formula C10H8N2O2 and molecular weight 188.05858 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(1H-benzimidazol-2-yl)prop-2-enoic acid
Also Known As: 3-(1H-Benzoimidazol-2-yl)-acrylic acid, 3-(1H-benzimidazol-2-yl)prop-2-enoic acid, 3-(benzimidazol-2-yl)-2-propenoic acid, 3-(1H-benzoimidazol-2-yl)prop-2-enoic Acid, (E)-3-(1H-benzo[d]imidazol-2-yl)acrylic acid
| Molecular Formula | C10H8N2O2 |
| Molecular Weight | 188.05858 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 66.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.05858 Da |
| Heavy Atoms | 14 |
| Complexity | 253.0 |
| SMILES | C1=CC=C2C(=C1)NC(=N2)C=CC(=O)O |
| InChIKey | FEGNPBYZFFAMCR-UHFFFAOYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1H-Benzoimidazol-2-yl)-acrylic acid. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1H-Benzoimidazol-2-yl)-acrylic acid. Following Lipinski's Rule of Five, 3-(1H-Benzoimidazol-2-yl)-acrylic acid 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 3-(1H-Benzoimidazol-2-yl)-acrylic acid is 152935-66-5.
The molecular formula of 3-(1H-Benzoimidazol-2-yl)-acrylic acid is C10H8N2O2.
The molecular weight of 3-(1H-Benzoimidazol-2-yl)-acrylic acid is 188.05858 g/mol.
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