SNAP 37889

Ligand id: 6126

Name: SNAP 37889

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 3
Topological polar surface area 32.67
Molecular weight 366.1
XLogP 7.73
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-phenyl-3-[3-(trifluoromethyl)phenyl]iminoindol-2-one
Synonyms
HT 2157 | HT-2157
Database Links
CAS Registry No. 303149-14-6 (source: SciFinder)
PubChem CID 1471834
Search Google for chemical match using the InChIKey TXCGMRVPXUBHAL-UHFFFAOYSA-N
Search Google for chemicals with the same backbone TXCGMRVPXUBHAL
Search UniChem for chemical match using the InChIKey TXCGMRVPXUBHAL-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone TXCGMRVPXUBHAL
Wikipedia HT-2157
Comments
This compound is represented on ChEMBL by the entry CHEMBL210288 which specified stereochemistry around the double bond.