Basic information
- Standard SMILES
COc1nc(Nc2ccc(OC(F)F)cc2)ncc1COc1ccc2[nH]c(=O)ccc2c1- InChIKey
CXHXFHIBAARUKX-UHFFFAOYSA-N- Molecular formula
- C22H18F2N4O4
- Average molar mass
- 440.4 g/mol
Names & identifiers
- Preferred name
- 6-((2-((4-(difluoromethoxy)phenyl)amino)-4-methoxypyrimidin-5-yl)methoxy)quinolin-2(1H)-one
- IUPAC
- 6-[[2-[4-(difluoromethoxy)anilino]-4-methoxypyrimidin-5-yl]methoxy]-1H-quinolin-2-one
Names & synonyms
6-((2-((4-(difluoromethoxy)phenyl)amino)-4-methoxypyrimidin-5-yl)methoxy)quinolin-2(1H)-oneSCHEMBL14800729
Database identifiers
- PubChem CID
- 86679754
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 94.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 647
Related reactions
1 records
Compound notes
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