N-benzyl-3-methyl-5-(2-oxo-4-phenethylpyridin-1(2H)-yl)thiophene-2-carboxamide
Basic information
- Standard SMILES
Cc1cc(-n2ccc(CCc3ccccc3)cc2=O)sc1C(=O)NCc1ccccc1- InChIKey
LEDBIKCVYRALPQ-UHFFFAOYSA-N- Molecular formula
- C26H24N2O2S
- Average molar mass
- 428.5 g/mol
- Monoisotopic mass
- 428.15584919
Names & identifiers
- Preferred name
- N-benzyl-3-methyl-5-(2-oxo-4-phenethylpyridin-1(2H)-yl)thiophene-2-carboxamide
- IUPAC
- N-benzyl-3-methyl-5-[2-oxo-4-(2-phenylethyl)-1-pyridinyl]thiophene-2-carboxamide
Names & synonyms
SCHEMBL3373774LEDBIKCVYRALPQ-UHFFFAOYSA-NN-benzyl-3-methyl-5-(2-oxo-4-phenethylpyridin-1(2H)-yl)thiophene-2-carboxamideN-benzyl-3-methyl-5-(2-oxo-4-phenethylpyridine-1(2H)-yl)thiophene-2-carboxamide
Database identifiers
- PubChem CID
- 57744497
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 77.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 692
Related reactions
2 records
Compound notes
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