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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 12371434Generated: October 26, 2026

5-(2-fluorophenyl)-7-nitro-3H-1,4-benzodiazepine-2(1H)-thione

https://huagongshe.com/en/chemical/12371434

5-(2-fluorophenyl)-7-nitro-3H-1,4-benzodiazepine-2(1H)-thione molecular structure

Identifiers & Physical Properties

Molecular formulaC15H10FN3O2S
Average molar mass315.3 g/mol
SMILESO=[N+]([O-])c1ccc2c(c1)C(c1ccccc1F)=NCC(=S)N2
InChIKeyVBXCZRGFEKYJDK-UHFFFAOYSA-N
PubChem CID12371434

Chemical & Physical Properties

XLogP2.7
Topological polar surface area102
Hydrogen bond donors1
Hydrogen bond acceptors5
Rotatable bonds1
Heavy atoms22
Formal charge0
Complexity494