Basic information
- Standard SMILES
CN1CCN(S(=O)(=O)c2ccc(B(O)O)cc2)CC1- InChIKey
WTIRVOVQNGLJIQ-UHFFFAOYSA-N- Molecular formula
- C11H17BN2O4S
- Average molar mass
- 284.14 g/mol
- Monoisotopic mass
- 284.1002084
Names & identifiers
- Preferred name
- (4-((4-Methylpiperazin-1-yl)sulfonyl)phenyl)boronic acid
- IUPAC
- [4-(4-methylpiperazin-1-yl)sulfonylphenyl]boronic acid
Names & synonyms
486422-11-1(4-((4-Methylpiperazin-1-yl)sulfonyl)phenyl)boronic acid4-(4-METHYL-PIPERAZINESULFONYL)PHENYL BORONIC ACIDMFCD12031677[4-(4-methylpiperazin-1-yl)sulfonylphenyl]boronic Acid4-[(4-Methylpiperazin-1-yl)sulfonyl]phenylboronic acid{4-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}boronic acid[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]boronic acidBoronic acid, [4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-SCHEMBL477530WTIRVOVQNGLJIQ-UHFFFAOYSA-NAKOS026673702
Show more names
AS-70853DB-305361CS-0059918W179254-(4-METHYL-PIPERAZINESULFONYL)PHENYLBORONICACID4-[(4-methyl-1-piperazinyl)sulfonyl]phenylboronic acid4-(4-METHYLPIPERAZIN-1-YLSULFONYL)PHENYLBORONIC ACID
Database identifiers
- PubChem CID
- 10423982
Properties
Computed structural properties
- Topological polar surface area
- 89.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 382
Related reactions
6 records
Compound notes
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