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

C15H12ClNO2S — CID 3349427

IUPAC2-(4-chlorophenyl)-3-(4-hydroxyphenyl)-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2ccc(Cl)cc2)N1c1ccc(O)cc1
InChIInChI=1S/C15H12ClNO2S/c16-11-3-1-10(2-4-11)15-17(14(19)9-20-15)12-5-7-13(18)8-6-12/h1-8,15,18H,9H2
InChIKeyFGEPIFMOIOTVHQ-UHFFFAOYSA-N
MW305.79 g/mol
LogP3.82
Rot. Bonds2

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

2-(4-chlorophenyl)-3-(4-hydroxyphenyl)-1,3-thiazolidin-4-one (PubChem CID 3349427) has the molecular formula C15H12ClNO2S and a molecular weight of 305.79 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-3-(4-hydroxyphenyl)-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-(4-chlorophenyl)-3-(4-hydroxyphenyl)-1,3-thiazolidin-4-one
PubChem CID3349427
Molecular FormulaC15H12ClNO2S
Molecular Weight305.79 g/mol
Exact Mass305.03
IUPAC Name2-(4-chlorophenyl)-3-(4-hydroxyphenyl)-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2ccc(Cl)cc2)N1c1ccc(O)cc1
InChIInChI=1S/C15H12ClNO2S/c16-11-3-1-10(2-4-11)15-17(14(19)9-20-15)12-5-7-13(18)8-6-12/h1-8,15,18H,9H2
InChIKeyFGEPIFMOIOTVHQ-UHFFFAOYSA-N
XLogP3.82
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.79
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-3-(4-hydroxyphenyl)-1,3-thiazolidin-4-one?
The IUPAC name of 2-(4-chlorophenyl)-3-(4-hydroxyphenyl)-1,3-thiazolidin-4-one (CID 3349427) is 2-(4-chlorophenyl)-3-(4-hydroxyphenyl)-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-(4-chlorophenyl)-3-(4-hydroxyphenyl)-1,3-thiazolidin-4-one?
The canonical SMILES for 2-(4-chlorophenyl)-3-(4-hydroxyphenyl)-1,3-thiazolidin-4-one is O=C1CSC(c2ccc(Cl)cc2)N1c1ccc(O)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-3-(4-hydroxyphenyl)-1,3-thiazolidin-4-one?
The InChIKey is FGEPIFMOIOTVHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClNO2S/c16-11-3-1-10(2-4-11)15-17(14(19)9-20-15)12-5-7-13(18)8-6-12/h1-8,15,18H,9H2.
What are the key properties of 2-(4-chlorophenyl)-3-(4-hydroxyphenyl)-1,3-thiazolidin-4-one?
2-(4-chlorophenyl)-3-(4-hydroxyphenyl)-1,3-thiazolidin-4-one has a molecular weight of 305.79 g/mol, XLogP of 3.82, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-3-(4-hydroxyphenyl)-1,3-thiazolidin-4-one is sourced from PubChem (CID 3349427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).