2-Aminomethyl-6-butylsulfamoyl-4-(1,1-dimethylethyl)phenol hydrochloride
Basic information
- Standard SMILES
CCCCNS(=O)(=O)c1cc(C(C)(C)C)cc(CN)c1O.Cl- InChIKey
GTWNAESXYZXGPR-UHFFFAOYSA-N- Molecular formula
- C15H27ClN2O3S
- Average molar mass
- 350.9 g/mol
Names & identifiers
- Preferred name
- 2-Aminomethyl-6-butylsulfamoyl-4-(1,1-dimethylethyl)phenol hydrochloride
- IUPAC
- 3-(aminomethyl)-N-butyl-5-tert-butyl-2-hydroxybenzenesulfonamide;hydrochloride
Names & synonyms
SCHEMBL10641838GTWNAESXYZXGPR-UHFFFAOYSA-N2-Aminomethyl-6-butylsulfamoyl-4-(1,1-dimethylethyl)-phenol hydrochloride2-Aminomethyl-6-butylsulfamoyl-4-(1,1-dimethylethyl)phenol hydrochloride
Database identifiers
- PubChem CID
- 21296934
Properties
Computed structural properties
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 412
Related reactions
2 records
Compound notes
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