3-[3-(1,3-Dioxolan-2-yl)-1,2-benzisothiazol-5-yl]-1-methyl-6-(trifluoromethyl)uracil

HCID 20634202
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Basic information

Standard SMILES
Cn1c(C(F)(F)F)cc(=O)n(-c2ccc3snc(C4OCCO4)c3c2)c1=O
InChIKey
ABZIDSFPVPQJPZ-UHFFFAOYSA-N
Molecular formula
C16H12F3N3O4S
Average molar mass
399.3 g/mol

Names & identifiers

Preferred name
3-[3-(1,3-Dioxolan-2-yl)-1,2-benzisothiazol-5-yl]-1-methyl-6-(trifluoromethyl)uracil
IUPAC
3-[3-(1,3-dioxolan-2-yl)-1,2-benzothiazol-5-yl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione

Names & synonyms

3-[3-(1,3-Dioxolan-2-yl)-1,2-benzisothiazol-5-yl]-1-methyl-6-(trifluoromethyl)uracilSCHEMBL6771154

Database identifiers

PubChem CID
20634202

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
100 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
9
Rotatable bonds
2
Heavy atoms
27

Related reactions

1 records
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Linked notes

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