Ethyl 4-(methylidene-lambda3-bromanyl)-5-[5-(3-methylsulfonylphenyl)-1,3,4-thiadiazol-2-yl]-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxylate

HCID 145632905

No structure available

Basic information

InChIKey: IMKYKUWBLDKPKV-UHFFFAOYSA-N
Molecular formula: C23H18BrF3N4O4S2
Average molar mass: 615.4 g/mol

Names & identifiers

Preferred name: Ethyl 4-(methylidene-lambda3-bromanyl)-5-[5-(3-methylsulfonylphenyl)-1,3,4-thiadiazol-2-yl]-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxylate
IUPAC: ethyl 4-(methylidene-λ3-bromanyl)-5-[5-(3-methylsulfonylphenyl)-1,3,4-thiadiazol-2-yl]-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxylate

Names & synonyms

IMKYKUWBLDKPKV-UHFFFAOYSA-NEthyl 4-(methylidene-lambda3-bromanyl)-5-[5-(3-methylsulfonylphenyl)-1,3,4-thiadiazol-2-yl]-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxylate

Database identifiers

PubChem CID: 145632905

Properties

Computed structural properties

XLogP: 5.7
Topological polar surface area: 141 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 11
Rotatable bonds: 8
Heavy atoms: 37
Formal charge: 0
Complexity: 938

Related reactions

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Compound notes

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