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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 66958599Generated: October 23, 2026

5-(3-benzenesulfonylpropyl)4-bromo-1-butyl-1H-pyrazole-3-carbonitrile

https://huagongshe.com/en/chemical/66958599

5-(3-benzenesulfonylpropyl)4-bromo-1-butyl-1H-pyrazole-3-carbonitrile molecular structure

Identifiers & Physical Properties

Molecular formulaC17H20BrN3O2S
Average molar mass410.3 g/mol
SMILESCCCCn1nc(C#N)c(Br)c1CCCS(=O)(=O)c1ccccc1
InChIKeyHEIHCDYKIBDBLU-UHFFFAOYSA-N
PubChem CID66958599

Chemical & Physical Properties

XLogP3.7
Topological polar surface area84.1
Hydrogen bond donors0
Hydrogen bond acceptors4
Rotatable bonds8
Heavy atoms24
Formal charge0
Complexity534