HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 166331Generated: November 4, 2026
Ethyl 2-[3-methyl-2-[5-(1-phenylpyrazol-3-yl)furan-2-yl]benzimidazol-3-ium-1-yl]acetate
https://huagongshe.com/en/chemical/166331
Identifiers & Physical Properties
| Molecular formula | C25H23N4O3+ |
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| Average molar mass | 427.5 g/mol |
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| Monoisotopic mass | 427.17701561 g/mol |
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| SMILES | CCOC(=O)Cn1c(-c2ccc(-c3ccn(-c4ccccc4)n3)o2)[n+](C)c2ccccc21 |
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| InChIKey | CPWNBQLRSKFCGX-UHFFFAOYSA-N |
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| PubChem CID | 166331 |
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Chemical & Physical Properties
| XLogP | 4.4 |
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| Topological polar surface area | 66.1 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 4 |
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| Rotatable bonds | 7 |
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| Heavy atoms | 32 |
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| Formal charge | 1 |
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| Complexity | 643 |
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![Ethyl 2-[3-methyl-2-[5-(1-phenylpyrazol-3-yl)furan-2-yl]benzimidazol-3-ium-1-yl]acetate molecular structure](/img/chemical/166331.png)