Basic information
- Standard SMILES
Cl.Cl.c1ccc2c3c([nH]c2c1)CN(CCCCc1ccncc1)CC3- InChIKey
SUJZIINRRIKNFK-UHFFFAOYSA-N- Molecular formula
- C20H25Cl2N3
- Average molar mass
- 378.3 g/mol
- Monoisotopic mass
- 377.1425532
Names & identifiers
- Preferred name
- 2,3,4,9-Tetrahydro-2-[4-(4-Pyridinyl)butyl]-1H-Pyrido[3,4-b]Indole Dihydrochloride
- IUPAC
- 2-(4-pyridin-4-ylbutyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole;dihydrochloride
Names & synonyms
SCHEMBL10667418SUJZIINRRIKNFK-UHFFFAOYSA-N2,3,4,9-Tetrahydro-2-[4-(4-Pyridinyl)butyl]-1H-Pyrido[3,4-b]Indole Dihydrochloride
Database identifiers
- PubChem CID
- 20155415
Properties
Computed structural properties
- Topological polar surface area
- 31.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 366
Related reactions
1 records
Compound notes
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