N-5-isoquinolinyl-N'-[4-(4-morpholinyl)benzyl]urea

HCID 10248092

Basic information

Standard SMILES
O=C(NCc1ccc(N2CCOCC2)cc1)Nc1cccc2cnccc12
InChIKey
LAJBRLBYOVKUOY-UHFFFAOYSA-N
Molecular formula
C21H22N4O2
Average molar mass
362.4 g/mol

Names & identifiers

Preferred name
N-5-isoquinolinyl-N'-[4-(4-morpholinyl)benzyl]urea
IUPAC
1-isoquinolin-5-yl-3-[(4-morpholin-4-ylphenyl)methyl]urea

Names & synonyms

CHEMBL231105SCHEMBL4023640BDBM20341LAJBRLBYOVKUOY-UHFFFAOYSA-NPD179066DB-087437N-5-isoquinolinyl-N'-[4-(4-morpholinyl)benzyl]urea1-isoquinolin-5-yl-3-{[4-(morpholin-4-yl)phenyl]methyl}ureaN-isoquinolin-5-yl-N'-[(4-morpholin-4-ylphenyl)methyl]urea581810-30-2

Database identifiers

PubChem CID
10248092
ChEMBL
CHEMBL231105

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
66.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
27

Related reactions

9 records

Compound notes

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