N-[4-(1,3-benzodioxol-5-yl)-1-benzyl-3-methoxypyrazol-5-yl]-2-phenylethenesulfonamide

HCID 69733437
NotesReactions
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Basic information

Standard SMILES
COc1nn(Cc2ccccc2)c(NS(=O)(=O)C=Cc2ccccc2)c1-c1ccc2c(c1)OCO2
InChIKey
KWKMQGNBXSIPST-UHFFFAOYSA-N
Molecular formula
C26H23N3O5S
Average molar mass
489.5 g/mol

Names & identifiers

Preferred name
N-[4-(1,3-benzodioxol-5-yl)-1-benzyl-3-methoxypyrazol-5-yl]-2-phenylethenesulfonamide
IUPAC
N-[4-(1,3-benzodioxol-5-yl)-1-benzyl-3-methoxypyrazol-5-yl]-2-phenylethenesulfonamide

Names & synonyms

SCHEMBL6289188

Database identifiers

PubChem CID
69733437

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
100 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
8
Heavy atoms
35

Related reactions

1 records
New reaction record

Compound notes

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