Basic information
- Standard SMILES
Fc1cc(-c2nc(NCC3CCOCC3)c(Cl)cc2Cl)c(Cl)cn1- InChIKey
CWFRZLPIIQHYGI-UHFFFAOYSA-N- Molecular formula
- C16H15Cl3FN3O
- Average molar mass
- 390.7 g/mol
Names & identifiers
- Preferred name
- 3,5,5'-trichloro-2'-fluoro-N-((tetrahydro-2H-pyran-4-yl)methyl)-2,4'-bipyridin-6-amine
- IUPAC
- 3,5-dichloro-6-(5-chloro-2-fluoro-4-pyridinyl)-N-(oxan-4-ylmethyl)pyridin-2-amine
Names & synonyms
SCHEMBL1192198CWFRZLPIIQHYGI-UHFFFAOYSA-N3,5,5'-trichloro-2'-fluoro-N-((tetrahydro-2H-pyran-4-yl)methyl)-2,4'-bipyridin-6-amine
Database identifiers
- PubChem CID
- 66937015
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 47 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 403
Related reactions
3 records
Compound notes
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