Basic information
- Standard SMILES
COc1ccc(N2C(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc3S2(=O)=O)cc1OC- InChIKey
HFQYVHOLIXBBNR-UHFFFAOYSA-N- Molecular formula
- C22H18Cl2N2O5S
- Average molar mass
- 493.4 g/mol
Names & identifiers
- Preferred name
- 4-(2,6-Dichlorobenzyl)-2-(3,4-di methoxyphenyl)-2H-1,2,4-benzothiadiazin-3(4H)-one 1,1-dioxide
- IUPAC
- 4-[(2,6-dichlorophenyl)methyl]-2-(3,4-dimethoxyphenyl)-1,1-dioxo-1λ6,2,4-benzothiadiazin-3-one
Names & synonyms
SCHEMBL16680925HFQYVHOLIXBBNR-UHFFFAOYSA-N4-(2,6-Dichlorobenzyl)-2-(3,4-di methoxyphenyl)-2H-1,2,4-benzothiadiazin-3(4H)-one 1,1-dioxide4-(2,6-Dichlorobenzyl)-2-(3,4-dimethoxyphenyl)-2H-1,2,4-benzothiadiazin-3(4H)-one 1,1-dioxide
Database identifiers
- PubChem CID
- 72721177
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 84.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 769
Related reactions
1 records
Compound notes
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