Basic information
- CAS
389117-36-6- Standard SMILES
c1ccc(CCN2CCc3nc4ncccc4cc3C2)cc1- InChIKey
KPKDASQVZAVSAU-UHFFFAOYSA-N- Molecular formula
- C19H19N3
- Average molar mass
- 289.4 g/mol
- Monoisotopic mass
- 289.15789762
Names & identifiers
- Preferred name
- 7-(2-phenylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine
- IUPAC
- 7-(2-phenylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine
- English name
- Pyrido[2,3-b][1,6]naphthyridine, 6,7,8,9-tetrahydro-7-(2-phenylethyl)- (9CI)
- Molecular formula
- C19H19N3
- Molecular weight
- 289.37426
Names & synonyms
Peakdale1_000270389117-36-6HMS518M06DTXSID50408057SR-01000384716SR-01000384716-17-(2-Phenylethyl)-6,7,8,9-tetrahydropyrido[2,3-b][1,6]naphthyridinePyrido[2,3-b][1,6]naphthyridine, 6,7,8,9-tetrahydro-7-(2-phenylethyl)- (9CI)
Database identifiers
- CAS
389117-36-6- PubChem CID
- 5074009
- DTXSID
DTXSID50408057
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 29 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 353
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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