Basic information
- Standard SMILES
COc1cc(Br)c2oc3cc(-c4ccccc4Cl)c4c(c3c2c1)C(=O)NC4=O- InChIKey
YDRGXBRGSBTEFC-UHFFFAOYSA-N- Molecular formula
- C21H11BrClNO4
- Average molar mass
- 456.7 g/mol
Names & identifiers
- Preferred name
- 7-Bromo-4-(2-chlorophenyl)-9-methoxy-1H-[1]benzofuro[3,2-e]isoindole-1,3(2H)-dione
- IUPAC
- 7-bromo-4-(2-chlorophenyl)-9-methoxy-[1]benzofuro[3,2-e]isoindole-1,3-dione
Names & synonyms
SCHEMBL5829644YDRGXBRGSBTEFC-UHFFFAOYSA-N7-Bromo-4-(2-chlorophenyl)-9-methoxy-1H-[1]benzofuro[3,2-e]isoindole-1,3(2H)-dione
Database identifiers
- PubChem CID
- 21980347
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 68.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 662
Related reactions
3 records
Compound notes
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