Basic information
- Standard SMILES
C=C(C)COc1ccc(Cl)cc1CN(CC)c1ccc(C(=O)NS(=O)(=O)CCN2CCOCC2)nn1- InChIKey
BOFLZBDJKJTNOB-UHFFFAOYSA-N- Molecular formula
- C24H32ClN5O5S
- Average molar mass
- 538.1 g/mol
- Monoisotopic mass
- 537.181268
Names & identifiers
- Preferred name
- N-(2-(Morpholino)ethanesulphonyl)-6-[N-(5-chloro-2-(2-methylprop-2-en-1-yloxy)benzyl)-N-ethylamino]pyridazine-3-carboxamide
- IUPAC
- 6-[[5-chloro-2-(2-methylprop-2-enoxy)phenyl]methyl-ethylamino]-N-(2-morpholin-4-ylethylsulfonyl)pyridazine-3-carboxamide
Names & synonyms
SCHEMBL7810591BOFLZBDJKJTNOB-UHFFFAOYSA-NN-(2-(Morpholino)ethanesulphonyl)-6-[N-(5-chloro-2-(2-methylprop-2-en-1-yloxy)benzyl)-N-ethylamino]pyridazine-3-carboxamide
Database identifiers
- PubChem CID
- 18693229
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 12
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 820
Related reactions
2 records
Compound notes
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