Basic information
- Standard SMILES
CN(C(=O)c1ccccc1)c1ccc(Br)c2c1C(=O)c1ccccc1C2=O- InChIKey
MMFPRJLOIVSLAI-UHFFFAOYSA-N- Molecular formula
- C22H14BrNO3
- Average molar mass
- 420.3 g/mol
- Monoisotopic mass
- 419.01571
Names & identifiers
- Preferred name
- 4-bromo-N-benzoyl-1-methylaminoanthraquinone
- IUPAC
- N-(4-bromo-9,10-dioxoanthracen-1-yl)-N-methylbenzamide
Names & synonyms
SCHEMBL9165682MMFPRJLOIVSLAI-UHFFFAOYSA-N4-bromo-N-benzoyl-1-methylaminoanthraquinone
Database identifiers
- PubChem CID
- 19799445
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 615
Related reactions
2 records
Compound notes
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