Basic information
- Standard SMILES
O=C1Nc2cccc(Br)c2C1(O)c1cc2c(cc1O)OCC2- InChIKey
PCMMFJRPHDTUIG-UHFFFAOYSA-N- Molecular formula
- C16H12BrNO4
- Average molar mass
- 362.17 g/mol
Names & identifiers
- Preferred name
- 4-bromo-3-hydroxy-3-(6-hydroxy-2,3-dihydro-1-benzofuran-5-yl)-1,3-dihydro-2H-indol-2-one
- IUPAC
- 4-bromo-3-hydroxy-3-(6-hydroxy-2,3-dihydro-1-benzofuran-5-yl)-1H-indol-2-one
Names & synonyms
SCHEMBL282027PCMMFJRPHDTUIG-UHFFFAOYSA-N4-bromo-3-hydroxy-3-(6-hydroxy-2,3-dihydro-1-benzofuran-5-yl)-1,3-dihydro-2H-indol-2-one
Database identifiers
- PubChem CID
- 58872467
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 78.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 475
Related reactions
20 records
Compound notes
Loading…