HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 19082191Generated: November 3, 2026
1,3-Dihydro-3-methylthio-4-[2-[N-[6-(2-phenylethoxy)hexyl]-N-(phenylmethyl)-amino]ethyl]-7-phenylmethoxy-2H-indol-2-one
https://huagongshe.com/en/chemical/19082191
Identifiers & Physical Properties
| Molecular formula | C39H46N2O3S |
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| Average molar mass | 622.9 g/mol |
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| Monoisotopic mass | 622.32291451 g/mol |
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| SMILES | CSC1C(=O)Nc2c(OCc3ccccc3)ccc(CCN(CCCCCCOCCc3ccccc3)Cc3ccccc3)c21 |
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| InChIKey | IJNWJYICYNRUMI-UHFFFAOYSA-N |
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| PubChem CID | 19082191 |
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Chemical & Physical Properties
| XLogP | 8 |
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| Topological polar surface area | 76.1 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 19 |
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| Heavy atoms | 45 |
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| Formal charge | 0 |
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| Complexity | 810 |
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![1,3-Dihydro-3-methylthio-4-[2-[N-[6-(2-phenylethoxy)hexyl]-N-(phenylmethyl)-amino]ethyl]-7-phenylmethoxy-2H-indol-2-one molecular structure](/img/chemical/19082191.png)