5-[(1E)-2-(3-Nitrophenyl)vinyl]-3-(4-fluorophenyl)-1H-indazole

HCID 22480184

Basic information

Standard SMILES
O=[N+]([O-])c1cccc(/C=C/c2ccc3[nH]nc(-c4ccc(F)cc4)c3c2)c1
InChIKey
ISWUVPOUIMHFBC-SNAWJCMRSA-N
Molecular formula
C21H14FN3O2
Average molar mass
359.4 g/mol
Monoisotopic mass
359.10700486

Names & identifiers

Preferred name
5-[(1E)-2-(3-Nitrophenyl)vinyl]-3-(4-fluorophenyl)-1H-indazole
IUPAC
3-(4-fluorophenyl)-5-[(E)-2-(3-nitrophenyl)ethenyl]-1H-indazole

Names & synonyms

SCHEMBL5381689CHEMBL3921740ISWUVPOUIMHFBC-SNAWJCMRSA-N5-[(1e)-2-(3nitrophenyl)vinyl]-3-(4-fluorophenyl)-1h-indazole5-[(1E)-2-(3-Nitrophenyl)Vinyl]-3-(4-Fluorophenyl) -1H-Indazole5-[(1E)-2-(3-NITROPHENYL)VINYL]-3-(4-FLUOROPHENYL)-1H-INDAZOLE

Database identifiers

PubChem CID
22480184
ChEMBL
CHEMBL3921740

Properties

Computed structural properties

XLogP
5.4
Topological polar surface area
74.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
27

Related reactions

4 records

Compound notes

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