HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 66831766Generated: October 27, 2026
3-Methyl-4-oxo-N-(2-oxo-2-phenylethyl)-3,4-dihydroimidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide
https://huagongshe.com/en/chemical/66831766
Identifiers & Physical Properties
| Molecular formula | C14H12N6O3 |
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| Average molar mass | 312.28 g/mol |
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| SMILES | Cn1nnc2c(C(=O)NCC(=O)c3ccccc3)ncn2c1=O |
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| InChIKey | BXKHMKBAKHQSGF-UHFFFAOYSA-N |
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| PubChem CID | 66831766 |
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Chemical & Physical Properties
| XLogP | 0.8 |
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| Topological polar surface area | 109 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 6 |
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| Rotatable bonds | 4 |
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| Heavy atoms | 23 |
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| Formal charge | 0 |
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| Complexity | 531 |
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![3-Methyl-4-oxo-N-(2-oxo-2-phenylethyl)-3,4-dihydroimidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide molecular structure](/img/chemical/66831766.png)