Basic information
- Standard SMILES
CC(C)(C)OC(=O)NCc1nnc2ccc(C=O)nn12- InChIKey
AWYCXKNQJBZJFT-UHFFFAOYSA-N- Molecular formula
- C12H15N5O3
- Average molar mass
- 277.28 g/mol
Names & identifiers
- Preferred name
- Tert-butyl (6-formyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methylcarbamate
- IUPAC
- tert-butyl N-[(6-formyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]carbamate
Names & synonyms
SCHEMBL9910519AWYCXKNQJBZJFT-UHFFFAOYSA-NDB-173271tert-butyl (6-formyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methylcarbamateTert-butyl ((6-formyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl)carbamatetert-butyl (6-formyl-[1,2,4]-triazolo[4,3-b]pyridazin-3-yl)methylcarbamate1151802-33-3
Database identifiers
- PubChem CID
- 57691111
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 98.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 371
Related reactions
13 records
Compound notes
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