2-[1-(3,4-Dimethoxy-benzyl)-6-methoxy-7-isopropoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(pyridin-2-yl-methyl)-acetamide

HCID 11114033
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Basic information

Standard SMILES
COc1ccc(CC2c3cc(OC(C)C)c(OC)cc3CCN2CC(=O)NCc2ccccn2)cc1OC
InChIKey
CSPLRVSCMFPHEN-UHFFFAOYSA-N
Molecular formula
C30H37N3O5
Average molar mass
519.6 g/mol

Names & identifiers

Preferred name
2-[1-(3,4-Dimethoxy-benzyl)-6-methoxy-7-isopropoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(pyridin-2-yl-methyl)-acetamide
IUPAC
2-[1-[(3,4-dimethoxyphenyl)methyl]-6-methoxy-7-propan-2-yloxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(pyridin-2-ylmethyl)acetamide

Names & synonyms

SCHEMBL6382439CSPLRVSCMFPHEN-UHFFFAOYSA-N2-[1-(3,4-Dimethoxy-benzyl)-6-methoxy-7-isopropoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(pyridin-2-yl-methyl)-acetamide

Database identifiers

PubChem CID
11114033

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
82.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
11
Heavy atoms
38

Related reactions

1 records
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Compound notes

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