Basic information
- Standard SMILES
CC(C)Cc1cc(-c2cccc(CO)c2)c(S(=O)(=O)NC(C)(C)C)s1- InChIKey
LEYKPPRPUICCBC-UHFFFAOYSA-N- Molecular formula
- C19H27NO3S2
- Average molar mass
- 381.6 g/mol
Names & identifiers
- Preferred name
- 3-(3-Hydroxymethylphenyl)-5-iso-butyl-N-tert-butylthiophene-2-sulfonamide
- IUPAC
- N-tert-butyl-3-[3-(hydroxymethyl)phenyl]-5-(2-methylpropyl)thiophene-2-sulfonamide
Names & synonyms
SCHEMBL1359525LEYKPPRPUICCBC-UHFFFAOYSA-N3-(3-Hydroxymethylphenyl)-5-iso-butyl-N-tert-butylthiophene-2-sulfonamide
Database identifiers
- PubChem CID
- 67004658
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 522
Related reactions
5 records
Compound notes
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