Basic information
- Standard SMILES
COc1nccc2c1C(c1ccccc1C(F)(F)F)c1c(ccnc1OC(C)C)N2- InChIKey
KXQNLLVEGCKIEU-UHFFFAOYSA-N- Molecular formula
- C22H20F3N3O2
- Average molar mass
- 415.4 g/mol
Names & identifiers
- Preferred name
- (+/-)-5,10-Dihydro-1-isopropoxy-9-methoxy-10-(2-trifluoromethylphenyl)-pyrido[4,3-b][1,6]naphthyridine
- IUPAC
- 9-methoxy-1-propan-2-yloxy-10-[2-(trifluoromethyl)phenyl]-5,10-dihydropyrido[4,3-b][1,6]naphthyridine
Names & synonyms
(+/-)-5,10-dihydro-1-isopropoxy-9-methoxy-10-(2-trifluoromethylphenyl)-pyrido[4,3-b][1,6]naphthyridineSCHEMBL10639800
Database identifiers
- PubChem CID
- 14072014
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 56.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 576
Related reactions
2 records
Compound notes
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