2,2,2-TEMPS

Ligand id: 6329

Name: 2,2,2-TEMPS

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 10
Topological polar surface area 67.88
Molecular weight 416.14
XLogP 5.59
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2,2,2-trifluoro-N-(3-pentan-2-yloxyphenyl)-N-(pyridin-3-ylmethyl)ethanesulfonamide
Database Links
CAS Registry No. 353234-67-0 (source: Scifinder)
ChEMBL Ligand CHEMBL105296
PubChem CID 11362035
Search Google for chemical match using the InChIKey ICFXZBZASBXILF-UHFFFAOYSA-N
Search Google for chemicals with the same backbone ICFXZBZASBXILF
Search UniChem for chemical match using the InChIKey ICFXZBZASBXILF-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone ICFXZBZASBXILF