2-phenoxy-1-[(2R)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]ethanone

C18H16F3NO2S — CID 1024706

IUPAC2-phenoxy-1-[(2R)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]ethanone
SMILESO=C(COc1ccccc1)N1CCS[C@@H]1c1ccccc1C(F)(F)F
InChIInChI=1S/C18H16F3NO2S/c19-18(20,21)15-9-5-4-8-14(15)17-22(10-11-25-17)16(23)12-24-13-6-2-1-3-7-13/h1-9,17H,10-12H2/t17-/m1/s1
InChIKeyYQRMRWYVRGXJLG-QGZVFWFLSA-N
MW367.39 g/mol
LogP4.36
Rot. Bonds4

About 2-phenoxy-1-[(2R)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]ethanone

2-phenoxy-1-[(2R)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]ethanone (PubChem CID 1024706) has the molecular formula C18H16F3NO2S and a molecular weight of 367.39 g/mol. Its IUPAC name is 2-phenoxy-1-[(2R)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]ethanone.

Molecular Properties

Compound Name2-phenoxy-1-[(2R)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]ethanone
PubChem CID1024706
Molecular FormulaC18H16F3NO2S
Molecular Weight367.39 g/mol
Exact Mass367.09
IUPAC Name2-phenoxy-1-[(2R)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]ethanone
SMILESO=C(COc1ccccc1)N1CCS[C@@H]1c1ccccc1C(F)(F)F
InChIInChI=1S/C18H16F3NO2S/c19-18(20,21)15-9-5-4-8-14(15)17-22(10-11-25-17)16(23)12-24-13-6-2-1-3-7-13/h1-9,17H,10-12H2/t17-/m1/s1
InChIKeyYQRMRWYVRGXJLG-QGZVFWFLSA-N
XLogP4.36
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.39
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-phenoxy-1-[(2R)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-Fluorophenyl)-3-[2-(4-methoxyphenyl)ethyl]-1,3-thiazolidin-4-one
CID 4788849
2-(4-Fluorophenoxy)-1-(3-phenylpyrrolidin-1-yl)ethanone
CID 2927893
2-(3,4-Dimethylphenyl)-3-[2-(4-methoxyphenyl)ethyl]-1,3-thiazolidin-4-one
CID 9906009
N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(4-ethylphenoxy)-N-[4-(propan-2-yl)benzyl]acetamide
CID 4370898
N-benzyl-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(4-ethylphenoxy)acetamide
CID 4551957
1-[2-(3,4-Dimethylphenyl)-1,3-thiazolidin-3-yl]-2-phenoxyethan-1-one
CID 44418144
N-ethyl-N-(thiophen-2-ylmethyl)-2-[4-(trifluoromethyl)phenoxy]acetamide
CID 137647780
1-[2-(4-Methylphenyl)-1,3-thiazolidin-3-yl]-2-phenoxyethanone
CID 44418202
N-benzyl-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(4-ethylphenoxy)propanamide
CID 3789363
N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(3-fluorobenzyl)-2-(2-methylphenoxy)acetamide
CID 16438281
1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-fluorophenoxy)ethanone
CID 756939
2-(4-Fluorophenoxy)-1-(2-1,2,3,4-tetrahydroisoquinolyl)ethan-1-one
CID 1081721

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-1-[(2R)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]ethanone?
The IUPAC name of 2-phenoxy-1-[(2R)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]ethanone (CID 1024706) is 2-phenoxy-1-[(2R)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]ethanone.
What is the SMILES notation for 2-phenoxy-1-[(2R)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]ethanone?
The canonical SMILES for 2-phenoxy-1-[(2R)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]ethanone is O=C(COc1ccccc1)N1CCS[C@@H]1c1ccccc1C(F)(F)F.
What is the InChIKey of 2-phenoxy-1-[(2R)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]ethanone?
The InChIKey is YQRMRWYVRGXJLG-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H16F3NO2S/c19-18(20,21)15-9-5-4-8-14(15)17-22(10-11-25-17)16(23)12-24-13-6-2-1-3-7-13/h1-9,17H,10-12H2/t17-/m1/s1.
What are the key properties of 2-phenoxy-1-[(2R)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]ethanone?
2-phenoxy-1-[(2R)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]ethanone has a molecular weight of 367.39 g/mol, XLogP of 4.36, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-1-[(2R)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]ethanone is sourced from PubChem (CID 1024706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).