HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 22748723Generated: October 23, 2026
2-[[2-(4-Methylphenyl)ethanethioyl]amino]-3-phenylpropanoic acid
https://huagongshe.com/en/chemical/22748723
Identifiers & Physical Properties
| Molecular formula | C18H19NO2S |
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| Average molar mass | 313.4 g/mol |
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| Monoisotopic mass | 313.11365002 g/mol |
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| SMILES | Cc1ccc(CC(=S)NC(Cc2ccccc2)C(=O)O)cc1 |
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| InChIKey | OIWLGOMUNOCICZ-UHFFFAOYSA-N |
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| PubChem CID | 22748723 |
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Chemical & Physical Properties
| XLogP | 3.7 |
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| Topological polar surface area | 81.4 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 3 |
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| Rotatable bonds | 6 |
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| Heavy atoms | 22 |
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| Formal charge | 0 |
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| Complexity | 371 |
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![2-[[2-(4-Methylphenyl)ethanethioyl]amino]-3-phenylpropanoic acid molecular structure](/img/chemical/22748723.png)