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Basic information
- Standard SMILES
N#Cc1cc2c(Oc3ccc(NC(=O)Nc4nccs4)c(F)c3)ccnc2cc1OCC1CO1- InChIKey
GCFBWBGOPLLNEL-UHFFFAOYSA-N- Molecular formula
- C23H16FN5O4S
- Average molar mass
- 477.5 g/mol
Names & identifiers
- Preferred name
- N-[4-(6-Cyano-7-oxiranylmethoxyquinolin-4-yloxy)-2-fluorophenyl]-N'-(thiazol-2-yl)urea
- IUPAC
- 1-[4-[6-cyano-7-(oxiran-2-ylmethoxy)quinolin-4-yl]oxy-2-fluorophenyl]-3-(1,3-thiazol-2-yl)urea
Names & synonyms
SCHEMBL1893851GCFBWBGOPLLNEL-UHFFFAOYSA-NN-[4-(6-cyano-7-oxiranylmethoxy-quinolin-4-yloxy)-2-fluorophenyl]-N'-(thiazol-2-yl)ureaN-[4-(6-Cyano-7-oxiranylmethoxyquinolin-4-yloxy)-2-fluorophenyl]-N'-(thiazol-2-yl)urea
Database identifiers
- PubChem CID
- 22936623
Properties
Computed structural propertiesFilling in
- XLogP
- 3.1
- Topological polar surface area
- 150 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 7
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 771
Related reactions
10 records
Compound notes
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