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benzoic acid N'-[2-(2'-fluoro-biphenyl-2-ylsulfanyl)-acetyl]-N'-isopropyl-hydrazide

HCID 11625972
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)N(NC(=O)c1ccccc1)C(=O)CSc1ccccc1-c1ccccc1F
InChIKey
WHBGXRCJBIBXOI-UHFFFAOYSA-N
Molecular formula
C24H23FN2O2S
Average molar mass
422.5 g/mol

Names & identifiers

Preferred name
benzoic acid N'-[2-(2'-fluoro-biphenyl-2-ylsulfanyl)-acetyl]-N'-isopropyl-hydrazide
IUPAC
N'-[2-[2-(2-fluorophenyl)phenyl]sulfanylacetyl]-N'-propan-2-ylbenzohydrazide

Names & synonyms

SCHEMBL14277773WHBGXRCJBIBXOI-UHFFFAOYSA-Nbenzoic acid N'-[2-(2'-fluoro-biphenyl-2-ylsulfanyl)-acetyl]-N'-isopropyl-hydrazide

Database identifiers

PubChem CID
11625972

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
74.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
30
Formal charge
0
Complexity
567

Related reactions

2 records
New reaction record
HRID 1557181 reaction equation
HRID 1557181As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 2250945 reaction equation
HRID 2250945As productuspto-grants-2008_01

Compound notes

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