Basic information
- Standard SMILES
CCOC(=O)c1cccc(-c2nn(Cc3ccccc3)c3ccccc23)c1- InChIKey
DGCOVLUYNUVONV-UHFFFAOYSA-N- Molecular formula
- C23H20N2O2
- Average molar mass
- 356.4 g/mol
Names & identifiers
- Preferred name
- 1-Benzyl-3-(3'-ethoxycarbonylphenyl)indazole
- IUPAC
- ethyl 3-(1-benzylindazol-3-yl)benzoate
Names & synonyms
CHEMBL339091SCHEMBL7488323DGCOVLUYNUVONV-UHFFFAOYSA-N1-benzyl-3-(3'-ethoxycarbonylphenyl)indazole
Database identifiers
- PubChem CID
- 9928633
- ChEMBL
CHEMBL339091- Nikkaji
- J1.638.690A
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 491
Related reactions
1 records
Compound notes
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