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benzoic acid N'-[2-(4'-methoxy-biphenyl-2-ylsulfanyl)-acetyl]-N'-isopropyl-hydrazide

HCID 11510344
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Basic information

Standard SMILES
COc1ccc(-c2ccccc2SCC(=O)N(NC(=O)c2ccccc2)C(C)C)cc1
InChIKey
JJLHLWZMAMJUKK-UHFFFAOYSA-N
Molecular formula
C25H26N2O3S
Average molar mass
434.6 g/mol

Names & identifiers

Preferred name
benzoic acid N'-[2-(4'-methoxy-biphenyl-2-ylsulfanyl)-acetyl]-N'-isopropyl-hydrazide
IUPAC
N'-[2-[2-(4-methoxyphenyl)phenyl]sulfanylacetyl]-N'-propan-2-ylbenzohydrazide

Names & synonyms

SCHEMBL14277772JJLHLWZMAMJUKK-UHFFFAOYSA-Nbenzoic acid N'-[2-(4'-methoxy-biphenyl-2-ylsulfanyl)-acetyl]-N'-isopropyl-hydrazide

Database identifiers

PubChem CID
11510344

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
83.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
31
Formal charge
0
Complexity
571

Related reactions

2 records
New reaction record
HRID 1560369 reaction equation
HRID 1560369As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 2250946 reaction equation
HRID 2250946As productuspto-grants-2008_01

Compound notes

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