Basic information
- Standard SMILES
Cc1ccc(CCn2c3c(c4cc(Br)ccc42)CN(C)CC3)cn1- InChIKey
PGLWUANRRACGLL-UHFFFAOYSA-N- Molecular formula
- C20H22BrN3
- Average molar mass
- 384.3 g/mol
Names & identifiers
- Preferred name
- 9-(2-(2-Methyl-5-pyridyl)ethyl)-6-bromo-3-methyl-1,2,3,4-tetrahydro-gamma-carboline
- IUPAC
- 8-bromo-2-methyl-5-[2-(6-methyl-3-pyridinyl)ethyl]-3,4-dihydro-1H-pyrido[4,3-b]indole
Names & synonyms
SCHEMBL36226979-(2-(2-Methyl-5-pyridyl)ethyl)-6-bromo-3-methyl-1,2,3,4-tetrahydro-.gamma.-carboline8-bromo-2-methyl-5-(2-(6-methylpyridin-3-yl)ethyl)-2,3,4,5-tetrahydro-1H-pyrido[4,3-b] indole8-bromo-2-methyl-5-(2-(6-methylpyridin-3-yl)ethyl)-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole8-Bromo-2-methyl-5-[2-(6-methyl-3-pyridinyl)ethyl]-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole #
Database identifiers
- PubChem CID
- 616495
- Nikkaji
- J526.283F
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 21.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 431
Related reactions
6 records
Compound notes
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