2-(1-benzyl-3-chloro-2-methyl-1H-indol-5-yl)-1,1,1,3,3,3-hexafluoro-propan-2-ol

HCID 11510046
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1c(Cl)c2cc(C(O)(C(F)(F)F)C(F)(F)F)ccc2n1Cc1ccccc1
InChIKey
ZIRHBNXXMWUNMY-UHFFFAOYSA-N
Molecular formula
C19H14ClF6NO
Average molar mass
421.8 g/mol
Monoisotopic mass
421.0668107

Names & identifiers

Preferred name
2-(1-benzyl-3-chloro-2-methyl-1H-indol-5-yl)-1,1,1,3,3,3-hexafluoro-propan-2-ol
IUPAC
2-(1-benzyl-3-chloro-2-methylindol-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol

Names & synonyms

2-(1-benzyl-3-chloro-2-methyl-1H-indol-5-yl)-1,1,1,3,3,3-hexafluoro-propan-2-olSCHEMBL1813839

Database identifiers

PubChem CID
11510046

Properties

Computed structural properties

XLogP
5.8
Topological polar surface area
25.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
3
Heavy atoms
28

Related reactions

3 records
New reaction record

Compound notes

Loading…