Basic information
- Standard SMILES
O=[N+]([O-])c1ccc(-n2nc(-c3ccc(O)cc3O)c3ccc(O)cc32)cc1- InChIKey
CLVHWTVJLXTBCL-UHFFFAOYSA-N- Molecular formula
- C19H13N3O5
- Average molar mass
- 363.3 g/mol
- Monoisotopic mass
- 363.08552052
Names & identifiers
- Preferred name
- 4-[6-Hydroxy-1-(4-nitrophenyl)-1h-indazol-3-yl]benzene-1,3-diol
- IUPAC
- 4-[6-hydroxy-1-(4-nitrophenyl)indazol-3-yl]benzene-1,3-diol
Names & synonyms
SCHEMBL4209397CLVHWTVJLXTBCL-UHFFFAOYSA-N4-[6-hydroxy-1-(4-nitrophenyl)-1h-indazol-3-yl]benzene-1,3-diol
Database identifiers
- PubChem CID
- 136409589
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 536
Related reactions
1 records
Compound notes
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