Basic information
- Standard SMILES
CC(C)(C)c1ccc(C(=O)NNS(=O)(=O)c2ccccc2)cc1- InChIKey
RDZRXNGRHJDBLZ-UHFFFAOYSA-N- Molecular formula
- C17H20N2O3S
- Average molar mass
- 332.4 g/mol
- Monoisotopic mass
- 332.11946368
Names & identifiers
- Preferred name
- 4-(1,1-Dimethylethyl)-benzoic acid, 2-(phenylsulfonyl)hydrazide
- IUPAC
- N'-(benzenesulfonyl)-4-tert-butylbenzohydrazide
Names & synonyms
SCHEMBL6397060RDZRXNGRHJDBLZ-UHFFFAOYSA-NAKOS0032387174-(1,1-Dimethylethyl)-benzoic acid, 2-(phenylsulfonyl)hydrazide
Database identifiers
- PubChem CID
- 923503
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 83.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 491
Related reactions
1 records
Compound notes
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