Basic information
- Standard SMILES
O=C(Nc1ccncc1)c1cnc2c(Nc3ccccn3)cc(N[C@H]3CCCNC3)nn12- InChIKey
AXHAFUBCIYZQCG-INIZCTEOSA-N- Molecular formula
- C22H23N9O
- Average molar mass
- 429.5 g/mol
- Monoisotopic mass
- 429.20255639
Names & identifiers
- Preferred name
- (S)-6-(piperidin-3-ylamino)-8-(pyridin-2-ylamino)-N-(pyridin-4-yl)imidazo[1,2-b]pyridazine-3-carboxamide
- IUPAC
- 6-[[(3S)-piperidin-3-yl]amino]-N-pyridin-4-yl-8-(pyridin-2-ylamino)imidazo[1,2-b]pyridazine-3-carboxamide
Names & synonyms
SCHEMBL3723535AXHAFUBCIYZQCG-INIZCTEOSA-N(S)-6-(piperidin-3-ylamino)-8-(pyridin-2-ylamino)-N-(pyridin-4-yl)imidazo[1,2-b]pyridazine-3-carboxamide
Database identifiers
- PubChem CID
- 59624562
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 616
Related reactions
1 records
Compound notes
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