Basic information
- Standard SMILES
Cn1c(=O)c(-c2ccc(Cl)cc2Cl)cc2c3cc(C(=O)CBr)ccc3n(C)c21- InChIKey
FZOOPMPZYUVZAQ-UHFFFAOYSA-N- Molecular formula
- C21H15BrCl2N2O2
- Average molar mass
- 478.2 g/mol
Names & identifiers
- Preferred name
- 6-(bromoacetyl)-3-(2,4-dichlorophenyl)-1,9-dimethyl-1,9-dihydro-2H-pyrido[2,3-b]indol-2-one
- IUPAC
- 6-(2-bromoacetyl)-3-(2,4-dichlorophenyl)-1,9-dimethylpyrido[2,3-b]indol-2-one
Names & synonyms
SCHEMBL1337009FZOOPMPZYUVZAQ-UHFFFAOYSA-N6-(bromoacetyl)-3-(2,4-dichlorophenyl)-1,9-dimethyl-1,9-dihydro-2H-pyrido[2,3-b]indol-2-one
Database identifiers
- PubChem CID
- 86623950
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 42.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 687
Related reactions
3 records
Compound notes
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