Basic information
- Standard SMILES
Nc1cccc2c(Oc3ccc(NC(=O)Nc4ccc(Cl)c(C(F)(F)F)c4)cc3)ccnc12- InChIKey
FIBZMEVNEQEVJT-UHFFFAOYSA-N- Molecular formula
- C23H16ClF3N4O2
- Average molar mass
- 472.8 g/mol
Names & identifiers
- Preferred name
- 1-[4-(8-Aminoquinolin-4-yloxy)phenyl]-3-(4-chloro-3-trifluoromethylphenyl)urea
- IUPAC
- 1-[4-(8-aminoquinolin-4-yl)oxyphenyl]-3-[4-chloro-3-(trifluoromethyl)phenyl]urea
Names & synonyms
1-[4-(8-aminoquinolin-4-yloxy)phenyl]-3-(4-chloro-3-trifluoromethylphenyl)ureaCHEMBL495636SCHEMBL2579421
Database identifiers
- PubChem CID
- 44583604
- ChEMBL
CHEMBL495636
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 89.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 662
Related reactions
2 records
Compound notes
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