Basic information
- Standard SMILES
CCCNn1c(=O)c(C2=NS(=O)(=O)c3cc(OCC(N)=O)ccc3N2)c(O)c2ccccc21- InChIKey
QKDYSMUPNASFMJ-UHFFFAOYSA-N- Molecular formula
- C21H21N5O6S
- Average molar mass
- 471.5 g/mol
Names & identifiers
- Preferred name
- 2-({3-[4-hydroxy-2-oxo-1-(propylamino)-1,2-dihydroquinolin-3-yl]-1,1-dioxido-4H-1,2,4-benzothiadiazin-7-yl}oxy)acetamide
- IUPAC
- 2-[[3-[4-hydroxy-2-oxo-1-(propylamino)quinolin-3-yl]-1,1-dioxo-4H-1λ6,2,4-benzothiadiazin-7-yl]oxy]acetamide
Names & synonyms
SCHEMBL1380681QKDYSMUPNASFMJ-UHFFFAOYSA-N2-({3-[4-hydroxy-2-oxo-1-(propylamino)-1,2-dihydroquinolin-3-yl]-1,1-dioxido-4H-1,2,4-benzothiadiazin-7-yl}oxy)acetamide
Database identifiers
- PubChem CID
- 136347380
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 172 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 959
Related reactions
2 records
Compound notes
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