3-(5,6-Dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(5-bromo-1H-indol-3-yl)-pyrrole-2,5-dione

HCID 22556869

Basic information

Standard SMILES
O=C1NC(=O)C(c2cn3c4c(cccc24)CCC3)=C1c1c[nH]c2ccc(Br)cc12
InChIKey
LLOCLQTXVAQSBK-UHFFFAOYSA-N
Molecular formula
C23H16BrN3O2
Average molar mass
446.3 g/mol

Names & identifiers

Preferred name
3-(5,6-Dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(5-bromo-1H-indol-3-yl)-pyrrole-2,5-dione
IUPAC
3-(1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-3-yl)-4-(5-bromo-1H-indol-3-yl)pyrrole-2,5-dione

Names & synonyms

SCHEMBL1395823LLOCLQTXVAQSBK-UHFFFAOYSA-N3-(5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(5-bromo-1H-indol-3-yl) pyrrole-2,5-dione3-(5,6-Dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(5-bromo-1H-indol-3-yl)-pyrrole-2,5-dione3-(5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(5-bromo-1H-indol-3-yl)pyrrole-2,5-dione3-(5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1yl)-4-(5-bromo-1H-indol-3-yl)pyrrole-2,5-dione

Database identifiers

PubChem CID
22556869

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
66.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
29

Related reactions

10 records

Compound notes

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