Basic information
- Standard SMILES
O=C(Nc1ccnc(Cl)c1)c1cnc2c(NC3CC3)cc(NC3CCOCC3)nn12- InChIKey
NTVMRNWSUHKAQS-UHFFFAOYSA-N- Molecular formula
- C20H22ClN7O2
- Average molar mass
- 427.9 g/mol
Names & identifiers
- Preferred name
- N-(2-chloropyridin-4-yl)-8-(cyclopropylamino)-6-(tetrahydro-2H-pyran-4-ylamino)imidazo[1,2-b]pyridazine-3-carboxamide
- IUPAC
- N-(2-chloro-4-pyridinyl)-8-(cyclopropylamino)-6-(oxan-4-ylamino)imidazo[1,2-b]pyridazine-3-carboxamide
Names & synonyms
SCHEMBL3718237NTVMRNWSUHKAQS-UHFFFAOYSA-NN-(2-chloropyridin-4-yl)-8-(cyclopropylamino)-6-(tetrahydro-2H-pyran-4-ylamino)imidazo[1,2-b]pyridazine-3-carboxamide
Database identifiers
- PubChem CID
- 59624377
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 604
Related reactions
2 records
Compound notes
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