Basic information
- Standard SMILES
CN1C(=O)C(c2cc3c(cc2O)OCCO3)c2c(Br)cccc21- InChIKey
HKGPNHAIIQJQNY-UHFFFAOYSA-N- Molecular formula
- C17H14BrNO4
- Average molar mass
- 376.2 g/mol
- Monoisotopic mass
- 375.01062
Names & identifiers
- Preferred name
- 4-bromo-3-(7-hydroxy-2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-1,3-dihydro-2H-indol-2-one
- IUPAC
- 4-bromo-3-(6-hydroxy-2,3-dihydro-1,4-benzodioxin-7-yl)-1-methyl-3H-indol-2-one
Names & synonyms
SCHEMBL2305376HKGPNHAIIQJQNY-UHFFFAOYSA-N4-bromo-3-(7-hydroxy-2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-1,3-dihydro-2H-indol-2-one
Database identifiers
- PubChem CID
- 67356935
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 476
Related reactions
6 records
Compound notes
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