Basic information
- Standard SMILES
C=CCC(O)(CC=C)c1cccc(Oc2ncccc2NC(=O)Nc2ccc(OC(F)(F)F)cc2)c1- InChIKey
UPGAFGYENCKSBH-UHFFFAOYSA-N- Molecular formula
- C26H24F3N3O4
- Average molar mass
- 499.5 g/mol
Names & identifiers
- Preferred name
- 1-(2-(3-(4-Hydroxyhepta-1,6-dien-4-yl)phenoxy)pyridin-3-yl)-3-(4-(trifluoromethoxy)phenyl)urea
- IUPAC
- 1-[2-[3-(4-hydroxyhepta-1,6-dien-4-yl)phenoxy]-3-pyridinyl]-3-[4-(trifluoromethoxy)phenyl]urea
Names & synonyms
1-(2-(3-(4-hydroxyhepta-1,6-dien-4-yl)phenoxy)pyridin-3-yl)-3-(4-(trifluoromethoxy)phenyl)ureaSCHEMBL3149719
Database identifiers
- PubChem CID
- 68529786
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 92.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 718
Related reactions
4 records
Compound notes
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