Basic information
- Standard SMILES
N#Cc1cc2c(Oc3ccc(NC(=O)Nc4ccc(F)cc4F)c(F)c3)ccnc2cc1OCc1ccccc1- InChIKey
KETGRHIQEIBIEF-UHFFFAOYSA-N- Molecular formula
- C30H19F3N4O3
- Average molar mass
- 540.5 g/mol
- Monoisotopic mass
- 540.14092497
Names & identifiers
- Preferred name
- N-(4-(6-Cyano-7-benzyloxy-4-quinolyl)oxy-2-fluorophenyl)-N'-(2,4-difluorophenyl)urea
- IUPAC
- 1-[4-(6-cyano-7-phenylmethoxyquinolin-4-yl)oxy-2-fluorophenyl]-3-(2,4-difluorophenyl)urea
Names & synonyms
SCHEMBL1893751KETGRHIQEIBIEF-UHFFFAOYSA-NN-(4-(6-Cyano-7-benzyloxy-4-quinolyl)oxy-2-fluorophenyl)-N'-(2,4-difluorophenyl)urea
Database identifiers
- PubChem CID
- 22936621
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 96.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 884
Related reactions
5 records
Compound notes
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