Basic information
- Standard SMILES
O=C(O)/C=C/C(=O)O.c1ccc(C(OC2CCN(CCCCCCOc3ccc4ncnn4n3)CC2)c2ccccc2)cc1- InChIKey
FJAADWVYKCICMK-WLHGVMLRSA-N- Molecular formula
- C33H39N5O6
- Average molar mass
- 601.7 g/mol
Names & identifiers
- Preferred name
- 6-[6-[4-(Diphenylmethoxy)piperidino]hexyloxy][1,2,4]triazolo[1,5-b]pyridazine Fumarate
- IUPAC
- 6-[6-(4-benzhydryloxypiperidin-1-yl)hexoxy]-[1,2,4]triazolo[1,5-b]pyridazine;(E)-but-2-enedioic acid
Names & synonyms
SCHEMBL7006837FJAADWVYKCICMK-WLHGVMLRSA-N6-[6-[4-(Diphenylmethoxy)piperidino]hexyloxy][1,2,4]triazolo[1,5-b]pyridazine Fumarate6-[6-[4-(diphenylmethoxy)piperidino]hexyloxy][1,2,4]triazolo[1,5-b]pyridazine fumaric acid salt
Database identifiers
- PubChem CID
- 22989384
Properties
Computed structural properties
- Topological polar surface area
- 139 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 14
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 705
Related reactions
2 records
Compound notes
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