N-[6-(4-Chloro-benzyloxymethyl)-pyridin-2-yl]-4-fluoro-3-trifluoromethyl-benzenesulfonamide

HCID 68845596
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
O=S(=O)(Nc1cccc(COCc2ccc(Cl)cc2)n1)c1ccc(F)c(C(F)(F)F)c1
InChIKey
XVKDHWGYESXJSW-UHFFFAOYSA-N
Molecular formula
C20H15ClF4N2O3S
Average molar mass
474.9 g/mol
Monoisotopic mass
474.0428039

Names & identifiers

Preferred name
N-[6-(4-Chloro-benzyloxymethyl)-pyridin-2-yl]-4-fluoro-3-trifluoromethyl-benzenesulfonamide
IUPAC
N-[6-[(4-chlorophenyl)methoxymethyl]-2-pyridinyl]-4-fluoro-3-(trifluoromethyl)benzenesulfonamide

Names & synonyms

N-[6-(4-Chloro-benzyloxymethyl)-pyridin-2-yl]-4-fluoro-3-trifluoromethyl-benzenesulfonamideSCHEMBL3935325

Database identifiers

PubChem CID
68845596

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
76.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
9
Rotatable bonds
7
Heavy atoms
31

Related reactions

2 records
New reaction record

Compound notes

Loading…