Basic information
- Standard SMILES
Cc1ccccc1S(=O)(=O)NCc1cc(=O)c(O)c(C(=O)NC(C)C)n1C- InChIKey
VVPPVVDKXFTKHR-UHFFFAOYSA-N- Molecular formula
- C18H23N3O5S
- Average molar mass
- 393.5 g/mol
Names & identifiers
- Preferred name
- 3-Hydroxy-1-methyl-4-oxo-6-[(toluene-2-sulfonylamino)-methyl]-1,4-dihydro-pyridine-2-carboxylic acid isopropylamide
- IUPAC
- 3-hydroxy-1-methyl-6-[[(2-methylphenyl)sulfonylamino]methyl]-4-oxo-N-propan-2-ylpyridine-2-carboxamide
Names & synonyms
SCHEMBL15861602VVPPVVDKXFTKHR-UHFFFAOYSA-N3-Hydroxy-1-methyl-4-oxo-6-[(toluene-2-sulfonylamino)-methyl]-1,4-dihydro-pyridine-2-carboxylic acid isopropylamide
Database identifiers
- PubChem CID
- 86725762
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 764
Related reactions
1 records
Compound notes
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