1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one

C15H13NO3S — CID 602051

IUPAC1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one
SMILESO=C1CS(=O)(=O)C(c2ccccc2)N1c1ccccc1
InChIInChI=1S/C15H13NO3S/c17-14-11-20(18,19)15(12-7-3-1-4-8-12)16(14)13-9-5-2-6-10-13/h1-10,15H,11H2
InChIKeyRQEIAMDCJRURGH-UHFFFAOYSA-N
MW287.34 g/mol
LogP2.15
Rot. Bonds2

About 1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one

1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one (PubChem CID 602051) has the molecular formula C15H13NO3S and a molecular weight of 287.34 g/mol. Its IUPAC name is 1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one
PubChem CID602051
Molecular FormulaC15H13NO3S
Molecular Weight287.34 g/mol
Exact Mass287.06
IUPAC Name1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one
SMILESO=C1CS(=O)(=O)C(c2ccccc2)N1c1ccccc1
InChIInChI=1S/C15H13NO3S/c17-14-11-20(18,19)15(12-7-3-1-4-8-12)16(14)13-9-5-2-6-10-13/h1-10,15H,11H2
InChIKeyRQEIAMDCJRURGH-UHFFFAOYSA-N
XLogP2.15
TPSA54.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one?
The IUPAC name of 1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one (CID 602051) is 1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one.
What is the SMILES notation for 1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one?
The canonical SMILES for 1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one is O=C1CS(=O)(=O)C(c2ccccc2)N1c1ccccc1.
What is the InChIKey of 1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one?
The InChIKey is RQEIAMDCJRURGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO3S/c17-14-11-20(18,19)15(12-7-3-1-4-8-12)16(14)13-9-5-2-6-10-13/h1-10,15H,11H2.
What are the key properties of 1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one?
1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one has a molecular weight of 287.34 g/mol, XLogP of 2.15, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one is sourced from PubChem (CID 602051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).