t-Butyl 2-[4-[(2-ethyl-6,8-dimethylimidazo[1,2-b]pyridazin-3-yl)methyl]phenyl]benzoate
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Basic information
- Standard SMILES
CCc1nc2c(C)cc(C)nn2c1Cc1ccc(-c2ccccc2C(=O)OC(C)(C)C)cc1- InChIKey
GVJGQLAUNKMBOS-UHFFFAOYSA-N- Molecular formula
- C28H31N3O2
- Average molar mass
- 441.6 g/mol
Names & identifiers
- Preferred name
- t-Butyl 2-[4-[(2-ethyl-6,8-dimethylimidazo[1,2-b]pyridazin-3-yl)methyl]phenyl]benzoate
- IUPAC
- tert-butyl 2-[4-[(2-ethyl-6,8-dimethylimidazo[1,2-b]pyridazin-3-yl)methyl]phenyl]benzoate
Names & synonyms
SCHEMBL9461629GVJGQLAUNKMBOS-UHFFFAOYSA-Nt-butyl 2-[4-[(2-ethyl-6,8-dimethylimidazo[1,2-b]pyridazin-3-yl)methyl]phenyl]benzoate
Database identifiers
- PubChem CID
- 19784151
Properties
Computed structural propertiesFilling in
- XLogP
- 6.3
- Topological polar surface area
- 56.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 654
Related reactions
4 records
Compound notes
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