Basic information
- CAS
114149-38-1- Standard SMILES
Cc1ccc(S(=O)(=O)NC2Cc3ccc(C4=NNC(=O)CC4)cc3C2)cc1- InChIKey
HPHBEFJDQBZDEF-UHFFFAOYSA-N- Molecular formula
- C20H21N3O3S
- Average molar mass
- 383.5 g/mol
Names & identifiers
- Preferred name
- Benzenesulfonamide, N-(2,3-dihydro-5-(1,4,5,6-tetrahydro-6-oxo-3-pyridazinyl)-1H-inden-2-yl)-4-methyl-
- IUPAC
- 4-methyl-N-[5-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide
Names & synonyms
114149-38-16-(2-p-Toluenesulphonamido-indan-5-yl)-4,5-dihydropyridazin-3(2H)-oneBenzenesulfonamide, N-(2,3-dihydro-5-(1,4,5,6-tetrahydro-6-oxo-3-pyridazinyl)-1H-inden-2-yl)-4-methyl-RefChem:3254074-Methyl-N-(5-(6-oxo-1,4,5,6-tetrahydropyridazin-3-yl)-2,3-dihydro-1H-inden-2-yl)benzenesulfonamideSCHEMBL10405611DTXSID60921282HPHBEFJDQBZDEF-UHFFFAOYSA-NL002181N-[5-(6-Hydroxy-4,5-dihydropyridazin-3-yl)-2,3-dihydro-1H-inden-2-yl]-4-methylbenzene-1-sulfonamide
Database identifiers
- CAS
114149-38-1- PubChem CID
- 3087367
- DTXSID
DTXSID60921282
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 96 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 692
Related reactions
2 records
Compound notes
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