Basic information
- Standard SMILES
CC(C)C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(N)=O- InChIKey
KHWZZRKECVSOOQ-LLVKDONJSA-N- Molecular formula
- C12H17ClN2O3S
- Average molar mass
- 304.79 g/mol
Names & identifiers
- Preferred name
- (2R)-2-(4-Chlorobenzenesulfonylamino)-4-methylpentanoic acid amide
- IUPAC
- (2R)-2-[(4-chlorophenyl)sulfonylamino]-4-methylpentanamide
Names & synonyms
SCHEMBL1871538SCHEMBL3973993KHWZZRKECVSOOQ-LLVKDONJSA-N(2R)-2-(4-chlorobenzenesulfonylamino)-4-methyl-pentanoic acid amide(2R)-2-(4-Chlorobenzenesulfonylamino)-4-methylpentanoic acid amide(r)-2-(4-chlorobenzenesulfonylamino)-4-methylpentanoic acid amide
Database identifiers
- PubChem CID
- 59001058
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 97.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 398
Related reactions
17 records
Compound notes
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