3-(3-amino4-chloro-6-fluoro-2-methoxyphenyl)-6-trifluoromethyl-2,4-(1H,3H)-pyrimidinedione

HCID 18315080
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1c(N)c(Cl)cc(F)c1-n1c(=O)cc(C(F)(F)F)[nH]c1=O
InChIKey
FVVIRAYROVXYDE-UHFFFAOYSA-N
Molecular formula
C12H8ClF4N3O3
Average molar mass
353.65 g/mol

Names & identifiers

Preferred name
3-(3-amino4-chloro-6-fluoro-2-methoxyphenyl)-6-trifluoromethyl-2,4-(1H,3H)-pyrimidinedione
IUPAC
3-(3-amino-4-chloro-6-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione

Names & synonyms

3-(3-amino4-chloro-6-fluoro-2-methoxyphenyl)-6-trifluoromethyl-2,4-(1H,3H)-pyrimidinedioneSCHEMBL76653753-(3-amino-4-chloro-6-fluoro-2-methoxyphenyl)-6-trifluoromethyl-2,4-(1H,3H)-pyrimidinedione

Database identifiers

PubChem CID
18315080

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
84.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
2
Heavy atoms
23

Related reactions

5 records
New reaction record

Linked notes

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3-(3-amino4-chloro-6-fluoro-2-methoxyphenyl)-6-trifluoromethyl-2,4-(1H,3H)-pyrimidinedione (HCID 18315080)｜Huagongshe