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Basic information
- CAS
152537-60-5- Standard SMILES
Cc1cc2ncnn2nc1OCC(C)(C)CCS(N)(=O)=O- InChIKey
LNALLUHBMZUXHQ-UHFFFAOYSA-N- Molecular formula
- C12H19N5O3S
- Average molar mass
- 313.38 g/mol
- Monoisotopic mass
- 313.12086047
Names & identifiers
- Preferred name
- 1-Butanesulfonamide, 3,3-dimethyl-4-((7-methyl(1,2,4)triazolo(1,5-b)pyridazin-6-yl)oxy)-
- IUPAC
- 3,3-dimethyl-4-[(7-methyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)oxy]butane-1-sulfonamide
Names & synonyms
6-(2,2-Dimethyl-4-sulfamoyl-1-butoxy)-7-methyl(1,2,4)triazolo(1,5-b)pyridazine1-Butanesulfonamide, 3,3-dimethyl-4-((7-methyl(1,2,4)triazolo(1,5-b)pyridazin-6-yl)oxy)-152537-60-53,3-Dimethyl-4-((7-methyl(1,2,4)triazolo(1,5-b)pyridazin-6-yl)oxy)-1-butanesulfonamideDTXSID501650526-(2,2-dimethyl-4-sulfamoyl-1-butoxy)-7-methyl[1,2,4]triazolo[1,5-b]pyridazineRefChem:228771DTXCID8087543SCHEMBL8314483LNALLUHBMZUXHQ-UHFFFAOYSA-N3,3-Dimethyl-4-[(7-methyl[1,2,4]triazolo[1,5-b]pyridazin-6-yl)oxy]butane-1-sulfonamide
Database identifiers
- CAS
152537-60-5- PubChem CID
- 3073787
- DTXSID
DTXSID50165052
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 450
Related reactions
2 records
Compound notes
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