2-(2,4-difluorophenyl)-3-(2-hydroxyethyl)-1,3-thiazolidin-4-one

C11H11F2NO2S — CID 24712042

IUPAC2-(2,4-difluorophenyl)-3-(2-hydroxyethyl)-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2ccc(F)cc2F)N1CCO
InChIInChI=1S/C11H11F2NO2S/c12-7-1-2-8(9(13)5-7)11-14(3-4-15)10(16)6-17-11/h1-2,5,11,15H,3-4,6H2
InChIKeyNBPIMXKRQAOJJW-UHFFFAOYSA-N
MW259.28 g/mol
LogP1.53
Rot. Bonds3

About 2-(2,4-difluorophenyl)-3-(2-hydroxyethyl)-1,3-thiazolidin-4-one

2-(2,4-difluorophenyl)-3-(2-hydroxyethyl)-1,3-thiazolidin-4-one (PubChem CID 24712042) has the molecular formula C11H11F2NO2S and a molecular weight of 259.28 g/mol. Its IUPAC name is 2-(2,4-difluorophenyl)-3-(2-hydroxyethyl)-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-(2,4-difluorophenyl)-3-(2-hydroxyethyl)-1,3-thiazolidin-4-one
PubChem CID24712042
Molecular FormulaC11H11F2NO2S
Molecular Weight259.28 g/mol
Exact Mass259.05
IUPAC Name2-(2,4-difluorophenyl)-3-(2-hydroxyethyl)-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2ccc(F)cc2F)N1CCO
InChIInChI=1S/C11H11F2NO2S/c12-7-1-2-8(9(13)5-7)11-14(3-4-15)10(16)6-17-11/h1-2,5,11,15H,3-4,6H2
InChIKeyNBPIMXKRQAOJJW-UHFFFAOYSA-N
XLogP1.53
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.28
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-Benzyl-2-phenylthiazolidin-4-one
CID 231889
2-(2-Fluorophenyl)-1,3-thiazolan-4-one
CID 2732088
3-Benzyl-1,3-thiazolidine-2,4-dione
CID 2788476
3-[3-(Dimethylamino)propyl]-2-(4-fluorophenyl)-1,3-thiazolidin-4-one;hydrochloride
CID 2872049
3-[3-(Dimethylamino)propyl]-2-(3-fluorophenyl)-1,3-thiazolidin-4-one;hydrochloride
CID 49860519
2,2-Dimethyl-1-(2-phenyl-1,3-thiazolidin-3-yl)propan-1-one
CID 155524881
2-(4-Fluorophenyl)-1,3-thiazolidin-4-one
CID 3779101
tert-Butyl 4-(hydroxymethyl)-2-phenyl-1,3-thiazolidine-3-carboxylate
CID 3064945
3-Cyclopropyl-2-phenyl-1,3-thiazolidin-4-one
CID 16044736
2-(4-Fluorophenyl)-3-(2-morpholin-4-ylethyl)-1,3-thiazolidin-4-one
CID 23775657
1-Benzyl-3,4-bis(2-hydroxyethylsulfanyl)pyrrole-2,5-dione
CID 46907174
3-Acetyl-2-(4-fluorophenyl)-1,3-thiazolidine-4-carboxylic acid
CID 362549

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenyl)-3-(2-hydroxyethyl)-1,3-thiazolidin-4-one?
The IUPAC name of 2-(2,4-difluorophenyl)-3-(2-hydroxyethyl)-1,3-thiazolidin-4-one (CID 24712042) is 2-(2,4-difluorophenyl)-3-(2-hydroxyethyl)-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-(2,4-difluorophenyl)-3-(2-hydroxyethyl)-1,3-thiazolidin-4-one?
The canonical SMILES for 2-(2,4-difluorophenyl)-3-(2-hydroxyethyl)-1,3-thiazolidin-4-one is O=C1CSC(c2ccc(F)cc2F)N1CCO.
What is the InChIKey of 2-(2,4-difluorophenyl)-3-(2-hydroxyethyl)-1,3-thiazolidin-4-one?
The InChIKey is NBPIMXKRQAOJJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F2NO2S/c12-7-1-2-8(9(13)5-7)11-14(3-4-15)10(16)6-17-11/h1-2,5,11,15H,3-4,6H2.
What are the key properties of 2-(2,4-difluorophenyl)-3-(2-hydroxyethyl)-1,3-thiazolidin-4-one?
2-(2,4-difluorophenyl)-3-(2-hydroxyethyl)-1,3-thiazolidin-4-one has a molecular weight of 259.28 g/mol, XLogP of 1.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorophenyl)-3-(2-hydroxyethyl)-1,3-thiazolidin-4-one is sourced from PubChem (CID 24712042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).