Basic information
- Standard SMILES
CC(c1ccc2ncn(C)c2c1)c1cnc2ccc(-c3cnn(CCOC4CCCCO4)c3)nn12- InChIKey
LSTVNOFUHDQUOP-UHFFFAOYSA-N- Molecular formula
- C26H29N7O2
- Average molar mass
- 471.6 g/mol
Names & identifiers
- Preferred name
- (Rac)-3-[1-(3-methyl-3h-benzoimidazol-5-yl)-ethyl]-6-{1-[2-(tetrahydro-pyran-2-yloxy)-ethyl]-1h-pyrazol-4-yl}-imidazo[1,2-b]pyridazine
- IUPAC
- 3-[1-(3-methylbenzimidazol-5-yl)ethyl]-6-[1-[2-(oxan-2-yloxy)ethyl]pyrazol-4-yl]imidazo[1,2-b]pyridazine
Names & synonyms
SCHEMBL3414111LSTVNOFUHDQUOP-UHFFFAOYSA-N(rac)-3-[1-(3-methyl-3h-benzoimidazol-5-yl)-ethyl]-6-{1-[2-(tetrahydro-pyran-2-yloxy)-ethyl]-1h-pyrazol-4-yl}-imidazo[1,2-b]pyridazine
Database identifiers
- PubChem CID
- 68633396
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 84.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 701
Related reactions
2 records
Compound notes
Loading…