(5R)-5-[(E)-2-(4-tert-butylphenyl)-2-(6-methoxy-5-phenylpyridin-2-yl)ethenyl]pyrrolidin-2-one
Basic information
- Standard SMILES
COc1nc(/C(=C/[C@H]2CCC(=O)N2)c2ccc(C(C)(C)C)cc2)ccc1-c1ccccc1- InChIKey
GBRHNXSMYNZWMM-DNQXDJSBSA-N- Molecular formula
- C28H30N2O2
- Average molar mass
- 426.5 g/mol
- Monoisotopic mass
- 426.2307282
Names & identifiers
- Preferred name
- (5R)-5-[(E)-2-(4-tert-butylphenyl)-2-(6-methoxy-5-phenylpyridin-2-yl)ethenyl]pyrrolidin-2-one
- IUPAC
- (5R)-5-[(E)-2-(4-tert-butylphenyl)-2-(6-methoxy-5-phenyl-2-pyridinyl)ethenyl]pyrrolidin-2-one
Names & synonyms
SCHEMBL2410738GBRHNXSMYNZWMM-DNQXDJSBSA-N(5R)-5-[(E)-2-(4-tert-butylphenyl)-2-(6-methoxy-5-phenylpyridin-2-yl)ethenyl]pyrrolidin-2-one
Database identifiers
- PubChem CID
- 67397019
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 653
Related reactions
1 records
Compound notes
Loading…