N-(3-(4-bromothiophen-2-yl)-3-hydroxypropyl)-2,2,2-trifluoroacetamide

HCID 86694591
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Basic information

Standard SMILES
O=C(NCCC(O)c1cc(Br)cs1)C(F)(F)F
InChIKey
CWBQABCUDWNTMV-UHFFFAOYSA-N
Molecular formula
C9H9BrF3NO2S
Average molar mass
332.14 g/mol

Names & identifiers

Preferred name
N-(3-(4-bromothiophen-2-yl)-3-hydroxypropyl)-2,2,2-trifluoroacetamide
IUPAC
N-[3-(4-bromothiophen-2-yl)-3-hydroxypropyl]-2,2,2-trifluoroacetamide

Names & synonyms

N-(3-(4-bromothiophen-2-yl)-3-hydroxypropyl)-2,2,2-trifluoroacetamideSCHEMBL15129112

Database identifiers

PubChem CID
86694591

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
77.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
17

Related reactions

2 records
New reaction record

Linked notes

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