Basic information
- Standard SMILES
O=C(Nc1ccc(I)cc1)Nc1cc(C(F)(F)F)ccc1F- InChIKey
IPSGPNXXRYUPKM-UHFFFAOYSA-N- Molecular formula
- C14H9F4IN2O
- Average molar mass
- 424.13 g/mol
- Monoisotopic mass
- 423.96957
Names & identifiers
- Preferred name
- 1-[2-Fluoro-5-(trifluoromethyl)phenyl]-3-(4-iodophenyl)urea
- IUPAC
- 1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-(4-iodophenyl)urea
Names & synonyms
1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-(4-iodophenyl)urea1-(2-fluoro-5-(trifluoromethyl)phenyl)-3-(4-iodophenyl)ureaSCHEMBL4340395
Database identifiers
- PubChem CID
- 69008564
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 386
Related reactions
3 records
Compound notes
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