methyl 2-methyl-3-(2-methyl-3-(trifluoromethyl)benzyl)-5-morpholino-3H-imidazo[4,5-b]pyridine-7-carboxylate
Basic information
- Standard SMILES
COC(=O)c1cc(N2CCOCC2)nc2c1nc(C)n2Cc1cccc(C(F)(F)F)c1C- InChIKey
QZELEWOEUQMFHQ-UHFFFAOYSA-N- Molecular formula
- C22H23F3N4O3
- Average molar mass
- 448.4 g/mol
Names & identifiers
- Preferred name
- methyl 2-methyl-3-(2-methyl-3-(trifluoromethyl)benzyl)-5-morpholino-3H-imidazo[4,5-b]pyridine-7-carboxylate
- IUPAC
- methyl 2-methyl-3-[[2-methyl-3-(trifluoromethyl)phenyl]methyl]-5-morpholin-4-ylimidazo[4,5-b]pyridine-7-carboxylate
Names & synonyms
methyl 2-methyl-3-(2-methyl-3-(trifluoromethyl)benzyl)-5-morpholino-3H-imidazo[4,5-b]pyridine-7-carboxylateSCHEMBL15055495
Database identifiers
- PubChem CID
- 89648239
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 69.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 661
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Related reactions
2 records
Compound notes
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