3-[3-(2-Bromo-ethoxy)-phenyl]-thieno[2,3-d]isoxazole

HCID 21983582
Substructure searchFind similar structures

Basic information

Standard SMILES
BrCCOc1cccc(-c2noc3ccsc23)c1
InChIKey
KWXJHIPYMMSUFN-UHFFFAOYSA-N
Molecular formula
C13H10BrNO2S
Average molar mass
324.19 g/mol

Names & identifiers

Preferred name
3-[3-(2-Bromo-ethoxy)-phenyl]-thieno[2,3-d]isoxazole
IUPAC
3-[3-(2-bromoethoxy)phenyl]thieno[2,3-d][1,2]oxazole

Names & synonyms

SCHEMBL6069820KWXJHIPYMMSUFN-UHFFFAOYSA-N3-[3-(2-bromo-ethoxy)-phenyl]-thieno[2,3-d]isoxazole3-[3-(2-bromo-ethoxy]phenyl]-thieno[2,3-d]isoxazole

Database identifiers

PubChem CID
21983582

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
63.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
18

Related reactions

53 records
New reaction record

Linked notes

Loading…

3-[3-(2-Bromo-ethoxy)-phenyl]-thieno[2,3-d]isoxazole (HCID 21983582)｜Huagongshe