3-(4-fluorophenyl)-2-(4-hydroxyphenyl)-1,3-thiazolidin-4-one

C15H12FNO2S — CID 130427988

IUPAC3-(4-fluorophenyl)-2-(4-hydroxyphenyl)-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2ccc(O)cc2)N1c1ccc(F)cc1
InChIInChI=1S/C15H12FNO2S/c16-11-3-5-12(6-4-11)17-14(19)9-20-15(17)10-1-7-13(18)8-2-10/h1-8,15,18H,9H2
InChIKeyRBPMRLJJPDKYGE-UHFFFAOYSA-N
MW289.33 g/mol
LogP3.31
Rot. Bonds2

About 3-(4-fluorophenyl)-2-(4-hydroxyphenyl)-1,3-thiazolidin-4-one

3-(4-fluorophenyl)-2-(4-hydroxyphenyl)-1,3-thiazolidin-4-one (PubChem CID 130427988) has the molecular formula C15H12FNO2S and a molecular weight of 289.33 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-2-(4-hydroxyphenyl)-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name3-(4-fluorophenyl)-2-(4-hydroxyphenyl)-1,3-thiazolidin-4-one
PubChem CID130427988
Molecular FormulaC15H12FNO2S
Molecular Weight289.33 g/mol
Exact Mass289.06
IUPAC Name3-(4-fluorophenyl)-2-(4-hydroxyphenyl)-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2ccc(O)cc2)N1c1ccc(F)cc1
InChIInChI=1S/C15H12FNO2S/c16-11-3-5-12(6-4-11)17-14(19)9-20-15(17)10-1-7-13(18)8-2-10/h1-8,15,18H,9H2
InChIKeyRBPMRLJJPDKYGE-UHFFFAOYSA-N
XLogP3.31
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-2-(4-hydroxyphenyl)-1,3-thiazolidin-4-one?
The IUPAC name of 3-(4-fluorophenyl)-2-(4-hydroxyphenyl)-1,3-thiazolidin-4-one (CID 130427988) is 3-(4-fluorophenyl)-2-(4-hydroxyphenyl)-1,3-thiazolidin-4-one.
What is the SMILES notation for 3-(4-fluorophenyl)-2-(4-hydroxyphenyl)-1,3-thiazolidin-4-one?
The canonical SMILES for 3-(4-fluorophenyl)-2-(4-hydroxyphenyl)-1,3-thiazolidin-4-one is O=C1CSC(c2ccc(O)cc2)N1c1ccc(F)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-2-(4-hydroxyphenyl)-1,3-thiazolidin-4-one?
The InChIKey is RBPMRLJJPDKYGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FNO2S/c16-11-3-5-12(6-4-11)17-14(19)9-20-15(17)10-1-7-13(18)8-2-10/h1-8,15,18H,9H2.
What are the key properties of 3-(4-fluorophenyl)-2-(4-hydroxyphenyl)-1,3-thiazolidin-4-one?
3-(4-fluorophenyl)-2-(4-hydroxyphenyl)-1,3-thiazolidin-4-one has a molecular weight of 289.33 g/mol, XLogP of 3.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-2-(4-hydroxyphenyl)-1,3-thiazolidin-4-one is sourced from PubChem (CID 130427988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).