Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCc2nc3cc(-n4ccc(OCc5ccc(C(F)(F)F)nc5)cc4=O)ccn3c2C1- InChIKey
FGDWVAHLRRHTCR-UHFFFAOYSA-N- Molecular formula
- C27H26F3N5O4
- Average molar mass
- 541.5 g/mol
Names & identifiers
- Preferred name
- tert-Butyl 7-(2-oxo-4-((6-(trifluoromethyl)pyridin-3-yl)methoxy)pyridin-1(2H)-yl)-3,4-dihydropyrido[4',3':4,5]imidazo[1,2-a]pyridine-2(1H)-carboxylate
- IUPAC
- tert-butyl 11-[2-oxo-4-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]-1-pyridinyl]-1,4,8-triazatricyclo[7.4.0.02,7]trideca-2(7),8,10,12-tetraene-4-carboxylate
Names & synonyms
tert-Butyl 7-(2-oxo-4-((6-(trifluoromethyl)pyridin-3-yl)methoxy)pyridin-1(2H)-yl)-3,4-dihydropyrido[4',3':4,5]imidazo[1,2-a]pyridine-2(1H)-carboxylateSCHEMBL10182700
Database identifiers
- PubChem CID
- 68056129
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 89.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 6
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 997
Related reactions
1 records
Compound notes
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