Basic information
- Standard SMILES
Cc1ccc2c(c1)c1c(n2-c2cccc(-c3cncc4ccccc34)c2)CCN(C)C1- InChIKey
RCXPADGZRPMAHO-UHFFFAOYSA-N- Molecular formula
- C28H25N3
- Average molar mass
- 403.5 g/mol
Names & identifiers
- Preferred name
- 5-(3-(isoquinolin-4-yl)phenyl)-2,8-dimethyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole
- IUPAC
- 5-(3-isoquinolin-4-ylphenyl)-2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indole
Names & synonyms
SCHEMBL2362417RCXPADGZRPMAHO-UHFFFAOYSA-N5-(3-(isoquinolin-4-yl)phenyl)-2,8-dimethyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole
Database identifiers
- PubChem CID
- 67378997
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 21.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 621
Related reactions
2 records
Compound notes
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