HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 12377784Generated: November 4, 2026
[5-Anilino-3-(methylamino)-4-nitrothiophen-2-yl](phenyl)methanone
https://huagongshe.com/en/chemical/12377784
Identifiers & Physical Properties
| CAS No. | 54252-38-9 |
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| Molecular formula | C18H15N3O3S |
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| Average molar mass | 353.4 g/mol |
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| Monoisotopic mass | 353.08341252 g/mol |
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| SMILES | CNc1c(C(=O)c2ccccc2)sc(Nc2ccccc2)c1[N+](=O)[O-] |
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| InChIKey | MFKWKOAKNRQJNB-UHFFFAOYSA-N |
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| PubChem CID | 12377784 |
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| DTXSID | DTXSID50495225 |
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Chemical & Physical Properties
| XLogP | 6.1 |
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| Topological polar surface area | 115 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 6 |
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| Rotatable bonds | 5 |
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| Heavy atoms | 25 |
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| Formal charge | 0 |
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| Complexity | 473 |
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methanone molecular structure](/img/chemical/12377784.png)