3-(6,6-dimethyl-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(6-trifluoromethyl-1H-indol-3-yl)pyrrole-2,5-dione
Basic information
- Standard SMILES
CC1(C)CCn2cc(C3=C(c4c[nH]c5cc(C(F)(F)F)ccc45)C(=O)NC3=O)c3cccc1c32- InChIKey
HKQRZOMLTDYLCT-UHFFFAOYSA-N- Molecular formula
- C26H20F3N3O2
- Average molar mass
- 463.4 g/mol
Names & identifiers
- Preferred name
- 3-(6,6-dimethyl-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(6-trifluoromethyl-1H-indol-3-yl)pyrrole-2,5-dione
- IUPAC
- 3-(9,9-dimethyl-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraen-3-yl)-4-[6-(trifluoromethyl)-1H-indol-3-yl]pyrrole-2,5-dione
Names & synonyms
3-(6,6-dimethyl-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(6-trifluoromethyl-1H-indol-3-yl)pyrrole-2,5-dioneSCHEMBL6334123
Database identifiers
- PubChem CID
- 22556871
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 66.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 929
Related reactions
1 records
Compound notes
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