4-{4-[(1-{[5-(4-Methoxyphenyl)-1,3,4-oxadiazol-2-yl]carbonyl}azetidin-3-yl)oxy]-3-methylbenzyl}morpholine

HCID 56597685
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Basic information

Standard SMILES
COc1ccc(-c2nnc(C(=O)N3CC(Oc4ccc(CN5CCOCC5)cc4C)C3)o2)cc1
InChIKey
YROPPGHKGDSYBH-UHFFFAOYSA-N
Molecular formula
C25H28N4O5
Average molar mass
464.5 g/mol
Monoisotopic mass
464.20597001

Names & identifiers

Preferred name
4-{4-[(1-{[5-(4-Methoxyphenyl)-1,3,4-oxadiazol-2-yl]carbonyl}azetidin-3-yl)oxy]-3-methylbenzyl}morpholine
IUPAC
[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-[3-[2-methyl-4-(morpholin-4-ylmethyl)phenoxy]azetidin-1-yl]methanone

Names & synonyms

SCHEMBL326592YROPPGHKGDSYBH-UHFFFAOYSA-N4-{4-[(1-{[5-(4-Methoxyphenyl)-1,3,4-oxadiazol-2-yl]carbonyl}azetidin-3-yl)oxy]-3-methylbenzyl}morpholine

Database identifiers

PubChem CID
56597685

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
90.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
7
Heavy atoms
34

Related reactions

2 records
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Compound notes

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