4-{[2-(2,4-Dichlorophenoxy)-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}morpholine

HCID 58168917
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Basic information

Standard SMILES
O=C(c1cnc(Oc2ccc(Cl)cc2Cl)nc1C(F)(F)F)N1CCOCC1
InChIKey
VHMQDYHIXZXBOF-UHFFFAOYSA-N
Molecular formula
C16H12Cl2F3N3O3
Average molar mass
422.2 g/mol

Names & identifiers

Preferred name
4-{[2-(2,4-Dichlorophenoxy)-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}morpholine
IUPAC
[2-(2,4-dichlorophenoxy)-4-(trifluoromethyl)pyrimidin-5-yl]-morpholin-4-ylmethanone

Names & synonyms

4-{[2-(2,4-dichlorophenoxy)-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}morpholineSCHEMBL541334

Database identifiers

PubChem CID
58168917

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
64.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
3
Heavy atoms
27

Related reactions

2 records
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Compound notes

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