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4-{[(2-Methoxy-ethyl)-methyl-amino]-methyl}-N-(4-methoxy-7-phenyl-benzooxazol-2-yl)-benzamide

HCID 10366234
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Basic information

Standard SMILES
COCCN(C)Cc1ccc(C(=O)Nc2nc3c(OC)ccc(-c4ccccc4)c3o2)cc1
InChIKey
HRXCGQKFBQDAQG-UHFFFAOYSA-N
Molecular formula
C26H27N3O4
Average molar mass
445.5 g/mol

Names & identifiers

Preferred name
4-{[(2-Methoxy-ethyl)-methyl-amino]-methyl}-N-(4-methoxy-7-phenyl-benzooxazol-2-yl)-benzamide
IUPAC
4-[[2-methoxyethyl(methyl)amino]methyl]-N-(4-methoxy-7-phenyl-1,3-benzoxazol-2-yl)benzamide

Names & synonyms

SCHEMBL5037926HRXCGQKFBQDAQG-UHFFFAOYSA-NL0231134-{[(2-Methoxy-ethyl)-methyl-amino]-methyl}-N-(4-methoxy-7-phenyl-benzooxazol-2-yl)-benzamide

Database identifiers

PubChem CID
10366234

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
76.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
9
Heavy atoms
33
Formal charge
0
Complexity
606

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Related reactions

2 records
New reaction record
HRID 1218574 reaction equation
HRID 1218574As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1611936 reaction equation
HRID 1611936As productuspto-grants-2006_01

Compound notes

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