(R)-2-[(4R,5S,6R)-6-((E)-3,3-dimethylbut-1-enyl)-5-hydroxy-2,2-dimethyl-1,3-dioxan-4-yl]-2-methoxy-N-(2-methyl-3-oxo-2,3,4,5-tetrahydro-1H-2-benzazepin-4-yl)acetamide

HCID 57722319
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Basic information

Standard SMILES
CO[C@@H](C(=O)NC1Cc2ccccc2CN(C)C1=O)[C@@H]1OC(C)(C)O[C@H](/C=C/C(C)(C)C)[C@@H]1O
InChIKey
HGSWEYDIXYWCHW-SUINSCANSA-N
Molecular formula
C26H38N2O6
Average molar mass
474.6 g/mol

Names & identifiers

Preferred name
(R)-2-[(4R,5S,6R)-6-((E)-3,3-dimethylbut-1-enyl)-5-hydroxy-2,2-dimethyl-1,3-dioxan-4-yl]-2-methoxy-N-(2-methyl-3-oxo-2,3,4,5-tetrahydro-1H-2-benzazepin-4-yl)acetamide
IUPAC
(2R)-2-[(4R,5S,6R)-6-[(E)-3,3-dimethylbut-1-enyl]-5-hydroxy-2,2-dimethyl-1,3-dioxan-4-yl]-2-methoxy-N-(2-methyl-3-oxo-4,5-dihydro-1H-2-benzazepin-4-yl)acetamide

Names & synonyms

SCHEMBL4499256HGSWEYDIXYWCHW-SUINSCANSA-N(R)-2-[(4R,5S,6R)-6-((E)-3,3-dimethylbut-1-enyl)-5-hydroxy-2,2-dimethyl-1,3-dioxan-4-yl]-2-methoxy-N-(2-methyl-3-oxo-2,3,4,5-tetrahydro-1H-2-benzazepin-4-yl)acetamide

Database identifiers

PubChem CID
57722319

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
97.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
34

Related reactions

2 records
New reaction record

Compound notes

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