4-chloro-2-phenyl-3-(trifluoromethyl)-1,3-thiazolidine

C10H9ClF3NS — CID 174269759

IUPAC4-chloro-2-phenyl-3-(trifluoromethyl)-1,3-thiazolidine
SMILESFC(F)(F)N1C(Cl)CSC1c1ccccc1
InChIInChI=1S/C10H9ClF3NS/c11-8-6-16-9(15(8)10(12,13)14)7-4-2-1-3-5-7/h1-5,8-9H,6H2
InChIKeyULLKLJKUWFOFIA-UHFFFAOYSA-N
MW267.70 g/mol
LogP3.82
Rot. Bonds1

About 4-chloro-2-phenyl-3-(trifluoromethyl)-1,3-thiazolidine

4-chloro-2-phenyl-3-(trifluoromethyl)-1,3-thiazolidine (PubChem CID 174269759) has the molecular formula C10H9ClF3NS and a molecular weight of 267.70 g/mol. Its IUPAC name is 4-chloro-2-phenyl-3-(trifluoromethyl)-1,3-thiazolidine.

Molecular Properties

Compound Name4-chloro-2-phenyl-3-(trifluoromethyl)-1,3-thiazolidine
PubChem CID174269759
Molecular FormulaC10H9ClF3NS
Molecular Weight267.70 g/mol
Exact Mass267.01
IUPAC Name4-chloro-2-phenyl-3-(trifluoromethyl)-1,3-thiazolidine
SMILESFC(F)(F)N1C(Cl)CSC1c1ccccc1
InChIInChI=1S/C10H9ClF3NS/c11-8-6-16-9(15(8)10(12,13)14)7-4-2-1-3-5-7/h1-5,8-9H,6H2
InChIKeyULLKLJKUWFOFIA-UHFFFAOYSA-N
XLogP3.82
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.70
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

3,4-ditert-butyl-2-phenyl-1,3-thiazolidine
CID 70865831
2-phenyl-3-(trifluoromethyl)-1,3-thiazolidin-5-ol
CID 174264849
5-chloro-3-methyl-2-phenyl-1,3-thiazolidine
CID 174266525
3-hydroxy-4-phenyl-1-(trifluoromethyl)imidazolidin-2-one
CID 174267984
(2R,4R)-3-acetyl-2-phenyl-1,3-thiazolidine-4-carboxylic acid
CID 759136
3-formyl-2-phenyl-1,3-thiazolidine-4-carboxylic acid
CID 85431501
3,3,3-trifluoro-1-(2-phenyl-1,3-thiazolidin-3-yl)propan-1-one
CID 122329235
2-(2-phenyl-1,3-thiazolidin-3-yl)ethanamine
CID 71179455
(7aR)-3,6-diphenyl-3,7a-dihydro-1H-imidazo[1,5-c][1,3]thiazole-5,7-dione
CID 59885924
(7R,7aR)-6-benzyl-7-hydroxy-3-phenyl-1,3,7,7a-tetrahydroimidazo[1,5-c][1,3]thiazol-5-one
CID 15612062
(7aR)-6-benzyl-7-hydroxy-3-phenyl-1,3,7,7a-tetrahydroimidazo[1,5-c][1,3]thiazol-5-one
CID 15612061
7-benzyl-3-phenyl-1,3,6,8a-tetrahydro-[1,3]thiazolo[3,4-a]pyrazine-5,8-dione
CID 44827800

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-phenyl-3-(trifluoromethyl)-1,3-thiazolidine?
The IUPAC name of 4-chloro-2-phenyl-3-(trifluoromethyl)-1,3-thiazolidine (CID 174269759) is 4-chloro-2-phenyl-3-(trifluoromethyl)-1,3-thiazolidine.
What is the SMILES notation for 4-chloro-2-phenyl-3-(trifluoromethyl)-1,3-thiazolidine?
The canonical SMILES for 4-chloro-2-phenyl-3-(trifluoromethyl)-1,3-thiazolidine is FC(F)(F)N1C(Cl)CSC1c1ccccc1.
What is the InChIKey of 4-chloro-2-phenyl-3-(trifluoromethyl)-1,3-thiazolidine?
The InChIKey is ULLKLJKUWFOFIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClF3NS/c11-8-6-16-9(15(8)10(12,13)14)7-4-2-1-3-5-7/h1-5,8-9H,6H2.
What are the key properties of 4-chloro-2-phenyl-3-(trifluoromethyl)-1,3-thiazolidine?
4-chloro-2-phenyl-3-(trifluoromethyl)-1,3-thiazolidine has a molecular weight of 267.70 g/mol, XLogP of 3.82, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-phenyl-3-(trifluoromethyl)-1,3-thiazolidine is sourced from PubChem (CID 174269759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).