HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 69918360Generated: November 1, 2026
(1S)-{1-(1h-indol-3-ylmethyl)-2-[5-(4-phenylaminomethyl-phenyl)-pyridin-3-yloxy]-ethyl}-carbamic acid tert-butyl ester
https://huagongshe.com/en/chemical/69918360
Identifiers & Physical Properties
| Molecular formula | C34H36N4O3 |
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| Average molar mass | 548.7 g/mol |
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| Monoisotopic mass | 548.27874102 g/mol |
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| SMILES | CC(C)(C)OC(=O)N[C@H](COc1cncc(-c2ccc(CNc3ccccc3)cc2)c1)Cc1c[nH]c2ccccc12 |
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| InChIKey | OLAWWXOWIBFTDU-LJAQVGFWSA-N |
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| PubChem CID | 69918360 |
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Chemical & Physical Properties
| XLogP | 6.8 |
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| Topological polar surface area | 88.3 |
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| Hydrogen bond donors | 3 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 12 |
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| Heavy atoms | 41 |
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| Formal charge | 0 |
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| Complexity | 789 |
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![(1S)-{1-(1h-indol-3-ylmethyl)-2-[5-(4-phenylaminomethyl-phenyl)-pyridin-3-yloxy]-ethyl}-carbamic acid tert-butyl ester molecular structure](/img/chemical/69918360.png)