Basic information
- Standard SMILES
O=Cc1cc(Oc2ccc3c(ccn3C(=O)Nc3cccc(C(F)(F)F)c3)c2)ncn1- InChIKey
BOPMOKMLFJEUJK-UHFFFAOYSA-N- Molecular formula
- C21H13F3N4O3
- Average molar mass
- 426.3 g/mol
Names & identifiers
- Preferred name
- 5-(6-Formyl-pyrimidin-4-yloxy)-indole-1-carboxylic acid (3-trifluoromethyl-phenyl)-amide
- IUPAC
- 5-(6-formylpyrimidin-4-yl)oxy-N-[3-(trifluoromethyl)phenyl]indole-1-carboxamide
Names & synonyms
5-(6-formyl-pyrimidin-4-yloxy)-indole-1-carboxylic acid (3-trifluoromethyl-phenyl)-amideSCHEMBL2503817
Database identifiers
- PubChem CID
- 86643085
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 86.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 650
Related reactions
19 records
Compound notes
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