Basic information
- Standard SMILES
COc1cc2nccc(Oc3ccc(NC(=S)NC(=O)c4ccccc4)cc3C)c2cc1OC- InChIKey
LUBWTBCINITLDX-UHFFFAOYSA-N- Molecular formula
- C26H23N3O4S
- Average molar mass
- 473.5 g/mol
- Monoisotopic mass
- 473.1409274
Names & identifiers
- Preferred name
- N-Benzoyl-N'-{4-[(6,7-dimethoxy-4-quinolyl)oxy]-3-methylphenyl}thiourea
- IUPAC
- N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-methylphenyl]carbamothioyl]benzamide
Names & synonyms
SCHEMBL5824873LUBWTBCINITLDX-UHFFFAOYSA-NN-Benzoyl-N'-{4-[(6,7-dimethoxy-4-quinolyl)oxy]-3-methylphenyl}thiourea
Database identifiers
- PubChem CID
- 21889930
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 689
Related reactions
2 records
Compound notes
Loading…