4-({4-[(4-Methoxyphenyl)sulfonyl]piperazin-1-yl}sulfonyl)-2,1,3-benzothiadiazole
Basic information
- CAS
669738-57-2- Standard SMILES
COc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)cc1- InChIKey
KPCAHZDRAYQZSD-UHFFFAOYSA-N- Molecular formula
- C17H18N4O5S3
- Average molar mass
- 454.6 g/mol
Names & identifiers
- Preferred name
- 4-({4-[(4-Methoxyphenyl)sulfonyl]piperazin-1-yl}sulfonyl)-2,1,3-benzothiadiazole
- IUPAC
- 4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]sulfonyl-2,1,3-benzothiadiazole
- English name
- 4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]sulfonyl-2,1,3-benzothiadiazole
- Molecular formula
- C17H18N4O5S3
- Molecular weight
- 454.54
Names & synonyms
4-({4-[(4-methoxyphenyl)sulfonyl]piperazin-1-yl}sulfonyl)-2,1,3-benzothiadiazole669738-57-2EiM07-33953STK409455AKOS003328502ST508469554-((4-((4-methoxyphenyl)sulfonyl)piperazin-1-yl)sulfonyl)benzo[c][1,2,5]thiadiazole4-({4-[(4-methoxyphenyl)sulfonyl]piperazinyl}sulfonyl)benzo[c]1,2,5-thiadiazol e4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]sulfonyl-2,1,3-benzothiadiazole2,1,3-Benzothiadiazole, 4-[[4-[(4-methoxyphenyl)sulfonyl]-1-piperazinyl]sulfonyl]-
Database identifiers
- CAS
669738-57-2
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 155 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 766
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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