6-Bromo-1-ethyl-4-hydroxy-N'-octanoyl-2-oxo-1,2-dihydroquinoline-3-carbohydrazide

HCID 71547577

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Basic information

Standard SMILES: CCCCCCCC(=O)NNC(=O)c1c(O)c2cc(Br)ccc2n(CC)c1=O
InChIKey: SYUGFUGELINXSH-UHFFFAOYSA-N
Molecular formula: C20H26BrN3O4
Average molar mass: 452.3 g/mol

Names & identifiers

Preferred name: 6-Bromo-1-ethyl-4-hydroxy-N'-octanoyl-2-oxo-1,2-dihydroquinoline-3-carbohydrazide
IUPAC: 6-bromo-1-ethyl-4-hydroxy-N'-octanoyl-2-oxoquinoline-3-carbohydrazide

Names & synonyms

6-Bromo-1-ethyl-4-hydroxy-N'-octanoyl-2-oxo-1,2-dihydroquinoline-3-carbohydrazideCHEMBL4103448SCHEMBL15966704SYUGFUGELINXSH-UHFFFAOYSA-NBDBM294082US9585879, 516-Bromo-1-ethyl-4-hydroxy-N'-octanoyl-2-oxo-1,2-dihydroquinoline-3--carbohydrazide

Database identifiers

PubChem CID: 71547577
ChEMBL: CHEMBL4103448

Properties

Computed structural properties

XLogP: 5
Topological polar surface area: 98.7 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 4
Rotatable bonds: 8
Heavy atoms: 28
Formal charge: 0
Complexity: 623

Related reactions

1 records

New reaction record

HRID 716695As productuspto-grants-2015_11

Compound notes

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