Basic information
- Standard SMILES
Cc1ccc2c(NCC(O)(CC(C)(C)c3cc(F)cc4c3OCC4)C(F)(F)F)c(C)ccc2n1- InChIKey
IWCPVHOGFNIOOY-UHFFFAOYSA-N- Molecular formula
- C26H28F4N2O2
- Average molar mass
- 476.5 g/mol
Names & identifiers
- Preferred name
- 5-[4-(5-Fluoro-2,3-dihydrobenzofuran-7-yl)-2-hydroxy-4-methyl-2-trifluoromethyl-pentylamino]-2,6-dimethylquinoline
- IUPAC
- 2-[[(2,6-dimethylquinolin-5-yl)amino]methyl]-1,1,1-trifluoro-4-(5-fluoro-2,3-dihydro-1-benzofuran-7-yl)-4-methylpentan-2-ol
Names & synonyms
5-[4-(5-Fluoro-2,3-dihydrobenzofuran-7-yl)-2-hydroxy-4-methyl-2-trifluoromethyl-pentylamino]-2,6-dimethylquinolineSCHEMBL290443SCHEMBL31390406
Database identifiers
- PubChem CID
- 11561978
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 705
Related reactions
2 records
Compound notes
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