HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 86629635Generated: October 27, 2026
7-chloro-6-[(1-methyl-indol-4-yl-methyl)-amino]-3-(2,2,2-trifluoroacetyl)-2,3,4,5-tetrahydro-1H-benzo[d]azepine
https://huagongshe.com/en/chemical/86629635
Identifiers & Physical Properties
| Molecular formula | C22H21ClF3N3O |
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| Average molar mass | 435.9 g/mol |
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| SMILES | Cn1ccc2c(CNc3c(Cl)ccc4c3CCN(C(=O)C(F)(F)F)CC4)cccc21 |
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| InChIKey | VYFJRZOFWIWPQE-UHFFFAOYSA-N |
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| PubChem CID | 86629635 |
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Chemical & Physical Properties
| XLogP | 5 |
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| Topological polar surface area | 37.3 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 3 |
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| Heavy atoms | 30 |
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| Formal charge | 0 |
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| Complexity | 619 |
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![7-chloro-6-[(1-methyl-indol-4-yl-methyl)-amino]-3-(2,2,2-trifluoroacetyl)-2,3,4,5-tetrahydro-1H-benzo[d]azepine molecular structure](/img/chemical/86629635.png)