Basic information
- Standard SMILES
COc1cc2nccc(Oc3ccc(NC(=S)NC(=O)c4ccc(C)cc4)c(F)c3)c2cc1OC- InChIKey
BPEFNLUAIWHXSU-UHFFFAOYSA-N- Molecular formula
- C26H22FN3O4S
- Average molar mass
- 491.5 g/mol
- Monoisotopic mass
- 491.13150553
Names & identifiers
- Preferred name
- N-{4-[(6,7-Dimethoxy-4-quinolyl)oxy]-2-fluorophenyl}-N'-(4-methylbenzoyl)thiourea
- IUPAC
- N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-fluorophenyl]carbamothioyl]-4-methylbenzamide
Names & synonyms
SCHEMBL5826128BPEFNLUAIWHXSU-UHFFFAOYSA-NN-{4-[(6,7-Dimethoxy-4-quinolyl)oxy]-2-fluorophenyl}-N'-(4-methylbenzoyl)thiourea
Database identifiers
- PubChem CID
- 21890396
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 723
Related reactions
2 records
Compound notes
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