N-(1-bromoisoquinolin-3-yl)-1-(4-methoxyphenyl)cyclopropanecarboxamide

HCID 57733030
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Basic information

Standard SMILES
COc1ccc(C2(C(=O)Nc3cc4ccccc4c(Br)n3)CC2)cc1
InChIKey
GCXNMLMLUZNOKK-UHFFFAOYSA-N
Molecular formula
C20H17BrN2O2
Average molar mass
397.3 g/mol
Monoisotopic mass
396.04734

Names & identifiers

Preferred name
N-(1-bromoisoquinolin-3-yl)-1-(4-methoxyphenyl)cyclopropanecarboxamide
IUPAC
N-(1-bromoisoquinolin-3-yl)-1-(4-methoxyphenyl)cyclopropane-1-carboxamide

Names & synonyms

SCHEMBL2905503GCXNMLMLUZNOKK-UHFFFAOYSA-NN-(1-bromoisoquinolin-3-yl)-1-(4-methoxyphenyl)cyclopropanecarboxamide

Database identifiers

PubChem CID
57733030

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
51.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
25

Related reactions

5 records
New reaction record

Compound notes

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N-(1-bromoisoquinolin-3-yl)-1-(4-methoxyphenyl)cyclopropanecarboxamide (HCID 57733030)｜Huagongshe