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3-(2-Benzyl-7-trifluoromethyl-2H-indazol-3-yl)-phenol

HCID 11617595
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Oc1cccc(-c2c3cccc(C(F)(F)F)c3nn2Cc2ccccc2)c1
InChIKey
GSPWQIYRRITPLJ-UHFFFAOYSA-N
Molecular formula
C21H15F3N2O
Average molar mass
368.4 g/mol

Names & identifiers

Preferred name
3-(2-Benzyl-7-trifluoromethyl-2H-indazol-3-yl)-phenol
IUPAC
3-[2-benzyl-7-(trifluoromethyl)indazol-3-yl]phenol

Names & synonyms

3-(2-Benzyl-7-trifluoromethyl-2H-indazol-3-yl)-phenolSCHEMBL14075203-(2-benzyl-7-trifluoromethyl-2H-indazole-3-yl)-phenol

Database identifiers

PubChem CID
11617595

Properties

Computed structural properties

XLogP
5.4
Topological polar surface area
38.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
27
Formal charge
0
Complexity
494

Related reactions

3 records
New reaction record
HRID 735476 reaction equation
HRID 735476As reactantuspto-grants-2009_09
HRID 735477 reaction equation
HRID 735477As reactantuspto-grants-2009_09
HRID 735482 reaction equation
HRID 735482As reactantuspto-grants-2009_09

Compound notes

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