2-(3,4-difluorophenyl)-3-(2,5-dimethylphenyl)-1,3-thiazolidin-4-one

C17H15F2NOS — CID 130386108

IUPAC2-(3,4-difluorophenyl)-3-(2,5-dimethylphenyl)-1,3-thiazolidin-4-one
SMILESCc1ccc(C)c(N2C(=O)CSC2c2ccc(F)c(F)c2)c1
InChIInChI=1S/C17H15F2NOS/c1-10-3-4-11(2)15(7-10)20-16(21)9-22-17(20)12-5-6-13(18)14(19)8-12/h3-8,17H,9H2,1-2H3
InChIKeyCUVCLEASQQBNJN-UHFFFAOYSA-N
MW319.38 g/mol
LogP4.36
Rot. Bonds2

About 2-(3,4-difluorophenyl)-3-(2,5-dimethylphenyl)-1,3-thiazolidin-4-one

2-(3,4-difluorophenyl)-3-(2,5-dimethylphenyl)-1,3-thiazolidin-4-one (PubChem CID 130386108) has the molecular formula C17H15F2NOS and a molecular weight of 319.38 g/mol. Its IUPAC name is 2-(3,4-difluorophenyl)-3-(2,5-dimethylphenyl)-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-(3,4-difluorophenyl)-3-(2,5-dimethylphenyl)-1,3-thiazolidin-4-one
PubChem CID130386108
Molecular FormulaC17H15F2NOS
Molecular Weight319.38 g/mol
Exact Mass319.08
IUPAC Name2-(3,4-difluorophenyl)-3-(2,5-dimethylphenyl)-1,3-thiazolidin-4-one
SMILESCc1ccc(C)c(N2C(=O)CSC2c2ccc(F)c(F)c2)c1
InChIInChI=1S/C17H15F2NOS/c1-10-3-4-11(2)15(7-10)20-16(21)9-22-17(20)12-5-6-13(18)14(19)8-12/h3-8,17H,9H2,1-2H3
InChIKeyCUVCLEASQQBNJN-UHFFFAOYSA-N
XLogP4.36
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.38
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-fluoro-4-methoxy-5-methylphenyl)-3-(5-fluoro-2-methylphenyl)-1,3-thiazolidin-4-one
CID 130428013
2-(3,4-difluorophenyl)-3-(4-iodophenyl)-1,3-thiazolidin-4-one
CID 4133056
3-[2-(4-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-4-methylbenzoic acid
CID 130385895
3-(3-chlorophenyl)-2-(3,4-difluorophenyl)-1,3-thiazolidin-4-one
CID 3370393
4-fluoro-N-[4-[(2R)-3-(2-fluoro-5-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]benzamide
CID 93127493
2-(3,4-difluorophenyl)-3-(4-ethoxyphenyl)-1,3-thiazolidin-4-one
CID 3370397
3-(3-chloro-4-methylphenyl)-2-(4-methylphenyl)-1,3-thiazolidin-4-one
CID 5057472
(2S)-2-(4-fluorophenyl)-3-(4-methylphenyl)-1,3-thiazolidin-4-one
CID 741588
(2S)-2-chloro-N-[3-[(2S)-3-(2,5-dimethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]-2-phenylacetamide
CID 93125271
2-chloro-N-[3-[(2R)-3-(2-fluoro-5-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]benzamide
CID 93127527
N-[3-[3-(2,5-dimethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]naphthalene-1-sulfonamide
CID 46132453
N-[3-[(2R)-3-(2-fluoro-5-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]-4-(trifluoromethyl)benzamide
CID 93127563

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-difluorophenyl)-3-(2,5-dimethylphenyl)-1,3-thiazolidin-4-one?
The IUPAC name of 2-(3,4-difluorophenyl)-3-(2,5-dimethylphenyl)-1,3-thiazolidin-4-one (CID 130386108) is 2-(3,4-difluorophenyl)-3-(2,5-dimethylphenyl)-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-(3,4-difluorophenyl)-3-(2,5-dimethylphenyl)-1,3-thiazolidin-4-one?
The canonical SMILES for 2-(3,4-difluorophenyl)-3-(2,5-dimethylphenyl)-1,3-thiazolidin-4-one is Cc1ccc(C)c(N2C(=O)CSC2c2ccc(F)c(F)c2)c1.
What is the InChIKey of 2-(3,4-difluorophenyl)-3-(2,5-dimethylphenyl)-1,3-thiazolidin-4-one?
The InChIKey is CUVCLEASQQBNJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F2NOS/c1-10-3-4-11(2)15(7-10)20-16(21)9-22-17(20)12-5-6-13(18)14(19)8-12/h3-8,17H,9H2,1-2H3.
What are the key properties of 2-(3,4-difluorophenyl)-3-(2,5-dimethylphenyl)-1,3-thiazolidin-4-one?
2-(3,4-difluorophenyl)-3-(2,5-dimethylphenyl)-1,3-thiazolidin-4-one has a molecular weight of 319.38 g/mol, XLogP of 4.36, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-difluorophenyl)-3-(2,5-dimethylphenyl)-1,3-thiazolidin-4-one is sourced from PubChem (CID 130386108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).