Basic information
- Standard SMILES
O=C(Nc1ccc(Oc2cc(F)ncn2)cc1)Nc1cccc(C(F)(F)F)c1- InChIKey
NLGZXHCVYJPFFP-UHFFFAOYSA-N- Molecular formula
- C18H12F4N4O2
- Average molar mass
- 392.3 g/mol
Names & identifiers
- Preferred name
- 1-[4-(6-Fluoro-pyrimidin-4-yloxy)-phenyl]-3-(3-trifluoromethyl-phenyl)-urea
- IUPAC
- 1-[4-(6-fluoropyrimidin-4-yl)oxyphenyl]-3-[3-(trifluoromethyl)phenyl]urea
Names & synonyms
1-[4-(6-Fluoro-pyrimidin-4-yloxy)-phenyl]-3-(3-trifluoromethyl-phenyl)-ureaSCHEMBL3186026
Database identifiers
- PubChem CID
- 58659409
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 76.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 514
Related reactions
2 records
Compound notes
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