Basic information
- Standard SMILES
N#Cc1cc2c(Oc3ccc(NC(=O)Nc4ccc(F)cc4)c(F)c3)ccnc2cc1OCC(O)CN1CCCCC1- InChIKey
YMQXIWZDYWEMQQ-UHFFFAOYSA-N- Molecular formula
- C31H29F2N5O4
- Average molar mass
- 573.6 g/mol
Names & identifiers
- Preferred name
- N-{4-[6-Cyano-7-(2-hydroxy-3-(piperidin-1-yl)propoxy)quinolin-4-yloxy]-2-fluorophenyl}-N'-(4-fluorophenyl)urea
- IUPAC
- 1-[4-[6-cyano-7-(2-hydroxy-3-piperidin-1-ylpropoxy)quinolin-4-yl]oxy-2-fluorophenyl]-3-(4-fluorophenyl)urea
Names & synonyms
SCHEMBL1893573SCHEMBL12503472YMQXIWZDYWEMQQ-UHFFFAOYSA-NN-{4-[6-Cyano-7-(2-hydroxy-3-(piperidin-1-yl)propoxy)quinolin-4-yloxy]-2-fluorophenyl}-N'-(4-fluorophenyl)urea
Database identifiers
- PubChem CID
- 67202808
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 9
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 909
Related reactions
5 records
Compound notes
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