Completing data — usually done within a minute
Basic information
- CAS
152537-56-9- Standard SMILES
CCC(CC)(COc1ccc2ncnn2n1)CS(N)(=O)=O- InChIKey
QBIBUTBKGQIKLI-UHFFFAOYSA-N- Molecular formula
- C12H19N5O3S
- Average molar mass
- 313.38 g/mol
- Monoisotopic mass
- 313.12086047
Names & identifiers
- Preferred name
- 1-Butanesulfonamide, 2-ethyl-2-(((1,2,4)triazolo(1,5-b)pyridazin-6-yloxy)methyl)-
- IUPAC
- 2-ethyl-2-([1,2,4]triazolo[1,5-b]pyridazin-6-yloxymethyl)butane-1-sulfonamide
Names & synonyms
1-Butanesulfonamide, 2-ethyl-2-(((1,2,4)triazolo(1,5-b)pyridazin-6-yloxy)methyl)-6-(2,2-Diethyl-3-sulfamoyl-1-propoxy)(1,2,4)triazolo(1,5-b)pyridazine152537-56-92-Ethyl-2-(((1,2,4)triazolo(1,5-b)pyridazin-6-yloxy)methyl)-1-butanesulfonamideDTXSID60165048RefChem:228768DTXCID4087539SCHEMBL8315804QBIBUTBKGQIKLI-UHFFFAOYSA-N6-(2,2-diethyl-3-sulfamoyl-1propoxy)[1,2,4]triazolo[1,5-b]pyridazine2-Ethyl-2-{[([1,2,4]triazolo[1,5-b]pyridazin-6-yl)oxy]methyl}butane-1-sulfonamide
Database identifiers
- CAS
152537-56-9- PubChem CID
- 3073783
- DTXSID
DTXSID60165048- Nikkaji
- J880.161D
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 435
Related reactions
2 records
Compound notes
Loading…