3-(5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(3-methoxyphenyl)-1H-pyrrole-2,5-dione
Basic information
- Standard SMILES
COc1cccc(C2=C(c3cn4c5c(cccc35)CCC4)C(=O)NC2=O)c1- InChIKey
CNMQNCLOXUUANY-UHFFFAOYSA-N- Molecular formula
- C22H18N2O3
- Average molar mass
- 358.4 g/mol
Names & identifiers
- Preferred name
- 3-(5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(3-methoxyphenyl)-1H-pyrrole-2,5-dione
- IUPAC
- 3-(1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-3-yl)-4-(3-methoxyphenyl)pyrrole-2,5-dione
Names & synonyms
SCHEMBL1395700CNMQNCLOXUUANY-UHFFFAOYSA-N3-(5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(3-methoxyphenyl)-1H-pyrrole-2,5-dione
Database identifiers
- PubChem CID
- 67017014
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 60.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 672
Related reactions
5 records
Compound notes
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