HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

N-[4-(4-Trifluoromethoxy-phenoxy)-phenyl]-methanesulfonamide

HCID 68514657
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CS(=O)(=O)Nc1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1
InChIKey
LGTWJTDYNRMYPE-UHFFFAOYSA-N
Molecular formula
C14H12F3NO4S
Average molar mass
347.31 g/mol

Names & identifiers

Preferred name
N-[4-(4-Trifluoromethoxy-phenoxy)-phenyl]-methanesulfonamide
IUPAC
N-[4-[4-(trifluoromethoxy)phenoxy]phenyl]methanesulfonamide

Names & synonyms

N-[4-(4-Trifluoromethoxy-phenoxy)-phenyl]-methanesulfonamideSCHEMBL3107843

Database identifiers

PubChem CID
68514657

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
73 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
5
Heavy atoms
23
Formal charge
0
Complexity
461

Related reactions

2 records
New reaction record
HRID 1569057 reaction equation
HRID 1569057As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1716301 reaction equation
HRID 1716301As productuspto-grants-2010_09

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes