N-(4-benzyloxy-3-methoxyphenylacetyl)-4-aminomethyl-2H-1-benzopyran

HCID 19813061
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Basic information

Standard SMILES
COc1cc(CC(=O)NCC2=CCOc3ccccc32)ccc1OCc1ccccc1
InChIKey
MEAQWTDNGRFBIP-UHFFFAOYSA-N
Molecular formula
C26H25NO4
Average molar mass
415.5 g/mol

Names & identifiers

Preferred name
N-(4-benzyloxy-3-methoxyphenylacetyl)-4-aminomethyl-2H-1-benzopyran
IUPAC
N-(2H-chromen-4-ylmethyl)-2-(3-methoxy-4-phenylmethoxyphenyl)acetamide

Names & synonyms

SCHEMBL9724444MEAQWTDNGRFBIP-UHFFFAOYSA-NN-(4-benzyloxy-3-methoxyphenylacetyl)-4-aminomethyl-2H-1-benzopyran

Database identifiers

PubChem CID
19813061

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
56.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
31

Related reactions

2 records
New reaction record

Compound notes

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