Basic information
- Standard SMILES
COc1cc2ncnc(Oc3ccc(NC(=S)NC(=O)c4cccc(C(F)(F)F)c4)cc3)c2cc1OC- InChIKey
GTPAZRFYWHLXAP-UHFFFAOYSA-N- Molecular formula
- C25H19F3N4O4S
- Average molar mass
- 528.5 g/mol
Names & identifiers
- Preferred name
- N-{4-[(6,7-Dimethoxy-4-quinazolinyl)oxy]phenyl}-N'-[3-(trifluoromethyl)benzoyl]thiourea
- IUPAC
- N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamothioyl]-3-(trifluoromethyl)benzamide
Names & synonyms
N-{4-[(6,7-Dimethoxy-4-quinazolinyl)oxy]phenyl}-N'-[3-(trifluoromethyl)benzoyl]thioureaSCHEMBL5824730N-{4-[(6,7-Dimethoxy-4-quinazolinyl)-oxy]phenyl}-N'-[3-(trifluoromethyl)benzoyl]thiourea
Database identifiers
- PubChem CID
- 21891007
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 6
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 784
Related reactions
1 records
Compound notes
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