N-(1-{[3-(Aminomethyl)phenyl]methyl}-4-fluoro-1H-indazol-3-yl)-5-chloro-2-thiophenesulfonamide

HCID 58054591
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(F)cccc32)c1
InChIKey
JDAGEFWOFRMZET-UHFFFAOYSA-N
Molecular formula
C19H16ClFN4O2S2
Average molar mass
450.9 g/mol
Monoisotopic mass
450.038724

Names & identifiers

Preferred name
N-(1-{[3-(Aminomethyl)phenyl]methyl}-4-fluoro-1H-indazol-3-yl)-5-chloro-2-thiophenesulfonamide
IUPAC
N-[1-[[3-(aminomethyl)phenyl]methyl]-4-fluoroindazol-3-yl]-5-chlorothiophene-2-sulfonamide

Names & synonyms

SCHEMBL356248JDAGEFWOFRMZET-UHFFFAOYSA-NN-(1-{[3-(Aminomethyl)phenyl]methyl}-4-fluoro-1H-indazol-3-yl)-5-chloro-2-thiophenesulfonamide

Database identifiers

PubChem CID
58054591

Properties

Computed structural properties

XLogP
4
Topological polar surface area
127 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
29

Related reactions

5 records
New reaction record

Compound notes

Loading…