Basic information
- Standard SMILES
COc1ccc(-c2cn(C(=O)c3c(OCC(F)(F)F)ccc4ccccc34)c3ncccc23)cc1OC1CCCC1- InChIKey
OLLCCHOCZXHOHL-UHFFFAOYSA-N- Molecular formula
- C32H27F3N2O4
- Average molar mass
- 560.6 g/mol
- Monoisotopic mass
- 560.19229183
Names & identifiers
- Preferred name
- [3-(3-Cyclopentyloxy-4-methoxy-phenyl)-pyrrolo[2,3-b]pyridin-1-yl]-[2-(2,2,2-trifluoro-ethoxy)-naphthalen-1-yl]-methanone
- IUPAC
- [3-(3-cyclopentyloxy-4-methoxyphenyl)pyrrolo[2,3-b]pyridin-1-yl]-[2-(2,2,2-trifluoroethoxy)naphthalen-1-yl]methanone
Names & synonyms
[3-(3-Cyclopentyloxy-4-methoxy-phenyl)-pyrrolo[2,3-b]pyridin-1-yl]-[2-(2,2,2-trifluoro-ethoxy)-naphthalen-1-yl]-methanoneSCHEMBL4330156
Database identifiers
- PubChem CID
- 57891726
Properties
Computed structural properties
- XLogP
- 8
- Topological polar surface area
- 62.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 883
Related reactions
2 records
Compound notes
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