N',6-dihydroxy-1'-(4-methoxybenzyl)-2'-oxo-1',2'-dihydrospiro[1-benzofuran-3,3'-indole]-5-carboximidamide
Basic information
- Standard SMILES
COc1ccc(CN2C(=O)C3(COc4cc(O)c(C(N)=NO)cc43)c3ccccc32)cc1- InChIKey
DKPXRUIVHPBSMC-UHFFFAOYSA-N- Molecular formula
- C24H21N3O5
- Average molar mass
- 431.4 g/mol
Names & identifiers
- Preferred name
- N',6-dihydroxy-1'-(4-methoxybenzyl)-2'-oxo-1',2'-dihydrospiro[1-benzofuran-3,3'-indole]-5-carboximidamide
- IUPAC
- N',6-dihydroxy-1'-[(4-methoxyphenyl)methyl]-2'-oxospiro[2H-1-benzofuran-3,3'-indole]-5-carboximidamide
Names & synonyms
SCHEMBL2308347SCHEMBL3327745DKPXRUIVHPBSMC-UHFFFAOYSA-NN',6-dihydroxy-1'-(4-methoxybenzyl)-2'-oxo-1',2'-dihydrospiro[1-benzofuran-3,3'-indole]-5-carboximidamide
Database identifiers
- PubChem CID
- 136348351
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 739
Related reactions
5 records
Compound notes
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