N-[(2R,3S)-3-(2,5-Dihydroxyphenyl)-5-hydroxy-3-methyl-2,3-dihydro-1-benzofuran-2-yl]-N-methylpropanamide
Basic information
- CAS
82334-16-5- Standard SMILES
CCC(=O)N(C)[C@@H]1Oc2ccc(O)cc2[C@]1(C)c1cc(O)ccc1O- InChIKey
LEAHLTNJVPIDGO-MOPGFXCFSA-N- Molecular formula
- C19H21NO5
- Average molar mass
- 343.4 g/mol
- Monoisotopic mass
- 343.14197277
Names & identifiers
- Preferred name
- N-[(2R,3S)-3-(2,5-Dihydroxyphenyl)-5-hydroxy-3-methyl-2,3-dihydro-1-benzofuran-2-yl]-N-methylpropanamide
- IUPAC
- N-[(2R,3S)-3-(2,5-dihydroxyphenyl)-5-hydroxy-3-methyl-2H-1-benzofuran-2-yl]-N-methylpropanamide
Names & synonyms
82334-16-5NSC365085DTXSID10320822NSC-365085N-[(2R,3S)-3-(2,5-Dihydroxyphenyl)-5-hydroxy-3-methyl-2,3-dihydro-1-benzofuran-2-yl]-N-methylpropanamide
Database identifiers
- CAS
82334-16-5- PubChem CID
- 339254
- DTXSID
DTXSID10320822
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 90.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 500
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…