(2R)-1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one

C15H13NO3S — CID 824881

IUPAC(2R)-1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one
SMILESO=C1CS(=O)(=O)[C@H](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/t15-/m1/s1
InChIKeyRQEIAMDCJRURGH-OAHLLOKOSA-N
MW287.34 g/mol
LogP2.15
Rot. Bonds2

About (2R)-1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one

(2R)-1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one (PubChem CID 824881) has the molecular formula C15H13NO3S and a molecular weight of 287.34 g/mol. Its IUPAC name is (2R)-1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name(2R)-1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one
PubChem CID824881
Molecular FormulaC15H13NO3S
Molecular Weight287.34 g/mol
Exact Mass287.06
IUPAC Name(2R)-1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one
SMILESO=C1CS(=O)(=O)[C@H](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/t15-/m1/s1
InChIKeyRQEIAMDCJRURGH-OAHLLOKOSA-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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Related Compounds

2-(4-chlorophenyl)-1,1-dioxo-3-(4-phenoxyphenyl)-1,3-thiazolidin-4-one
CID 3875714
(2R)-3-(4-methoxyphenyl)-1,1-dioxo-2-(4-phenoxyphenyl)-1,3-thiazolidin-4-one
CID 1274289
(2S)-3-(3-methoxyphenyl)-1,1-dioxo-2-(4-phenoxyphenyl)-1,3-thiazolidin-4-one
CID 1274296
(2S)-2-(4-chlorophenyl)-1,1-dioxo-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one
CID 1269425
2-(2-bromophenyl)-3-(3,5-dimethylphenyl)-1,1-dioxo-1,3-thiazolidin-4-one
CID 5197080
(2S,5S)-2-(4-bromophenyl)-5-methyl-1,1-dioxo-3-phenyl-1,3-thiazolidin-4-one
CID 42586501
1,4,5-triphenylpyrrolidin-2-one
CID 3541740
(5Z)-5-[(4-methoxyphenyl)methylidene]-1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one
CID 11836579
5-[(4-methoxyphenyl)methylidene]-1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one
CID 4623143
(4aR,7aS)-1,1,6,6-tetraoxo-4-phenyl-4a,5,7,7a-tetrahydrothieno[3,4-e][1,2,4]thiadiazin-3-one
CID 7138799
(4aR,7aR)-1,1,6,6-tetraoxo-4-phenyl-4a,5,7,7a-tetrahydrothieno[3,4-e][1,2,4]thiadiazin-3-one
CID 7138801
(2S)-3-[4-[(2S)-4-oxo-2-phenyl-1,3-thiazolidin-3-yl]phenyl]-2-phenyl-1,3-thiazolidin-4-one
CID 1041463

Frequently Asked Questions

What is the IUPAC name of (2R)-1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one?
The IUPAC name of (2R)-1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one (CID 824881) is (2R)-1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one.
What is the SMILES notation for (2R)-1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one?
The canonical SMILES for (2R)-1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one is O=C1CS(=O)(=O)[C@H](c2ccccc2)N1c1ccccc1.
What is the InChIKey of (2R)-1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one?
The InChIKey is RQEIAMDCJRURGH-OAHLLOKOSA-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/t15-/m1/s1.
What are the key properties of (2R)-1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one?
(2R)-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 (2R)-1,1-dioxo-2,3-diphenyl-1,3-thiazolidin-4-one is sourced from PubChem (CID 824881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).