3-(4-benzoylphenyl)-2-(furan-2-yl)-1,3-thiazolidin-4-one

C20H15NO3S — CID 10521764

IUPAC3-(4-benzoylphenyl)-2-(furan-2-yl)-1,3-thiazolidin-4-one
SMILESO=C(c1ccccc1)c1ccc(N2C(=O)CSC2c2ccco2)cc1
InChIInChI=1S/C20H15NO3S/c22-18-13-25-20(17-7-4-12-24-17)21(18)16-10-8-15(9-11-16)19(23)14-5-2-1-3-6-14/h1-12,20H,13H2
InChIKeyUASOPGHRCCUKQN-UHFFFAOYSA-N
MW349.41 g/mol
LogP4.29
Rot. Bonds4

About 3-(4-benzoylphenyl)-2-(furan-2-yl)-1,3-thiazolidin-4-one

3-(4-benzoylphenyl)-2-(furan-2-yl)-1,3-thiazolidin-4-one (PubChem CID 10521764) has the molecular formula C20H15NO3S and a molecular weight of 349.41 g/mol. Its IUPAC name is 3-(4-benzoylphenyl)-2-(furan-2-yl)-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name3-(4-benzoylphenyl)-2-(furan-2-yl)-1,3-thiazolidin-4-one
PubChem CID10521764
Molecular FormulaC20H15NO3S
Molecular Weight349.41 g/mol
Exact Mass349.08
IUPAC Name3-(4-benzoylphenyl)-2-(furan-2-yl)-1,3-thiazolidin-4-one
SMILESO=C(c1ccccc1)c1ccc(N2C(=O)CSC2c2ccco2)cc1
InChIInChI=1S/C20H15NO3S/c22-18-13-25-20(17-7-4-12-24-17)21(18)16-10-8-15(9-11-16)19(23)14-5-2-1-3-6-14/h1-12,20H,13H2
InChIKeyUASOPGHRCCUKQN-UHFFFAOYSA-N
XLogP4.29
TPSA50.52 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.41
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-(furan-2-yl)-3-[2-[(2S)-2-(furan-2-yl)-4-oxo-1,3-thiazolidin-3-yl]ethyl]-1,3-thiazolidin-4-one
CID 92530307
3-(4-benzoylphenyl)-2-(4-hydroxy-3-methoxyphenyl)-1,3-thiazolidin-4-one
CID 10573347
(2S)-3-[4-[(2S)-4-oxo-2-phenyl-1,3-thiazolidin-3-yl]phenyl]-2-phenyl-1,3-thiazolidin-4-one
CID 1041463
3-ethyl-2-(furan-2-yl)-1,3-thiazolidin-4-one
CID 3800198
methyl 2-[(2S)-2-(furan-2-yl)-4-oxo-1,3-thiazolidin-3-yl]acetate
CID 129362185
(2S)-2-(furan-2-yl)-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]methyl]-1,3-thiazolidin-4-one
CID 44613947
4-[(2R)-3-(furan-2-ylmethyl)-4-oxo-1,3-thiazolidin-2-yl]benzoic acid
CID 967754
3-(4-morpholin-4-ylphenyl)-2-phenyl-1,3-thiazolidin-4-one
CID 10337318
(2S)-3-(4-phenoxyphenyl)-2-phenyl-1,3-thiazolidin-4-one
CID 6935175
4-[(2S)-2-(4-nitrophenyl)-4-oxo-1,3-thiazolidin-3-yl]benzoic acid
CID 40546373
3-phenyl-2-pyridin-2-yl-1,3-thiazolidin-4-one
CID 3237434
(2S)-3-(4-ethylphenyl)-2-phenyl-1,3-thiazolidin-4-one
CID 95402321

Frequently Asked Questions

What is the IUPAC name of 3-(4-benzoylphenyl)-2-(furan-2-yl)-1,3-thiazolidin-4-one?
The IUPAC name of 3-(4-benzoylphenyl)-2-(furan-2-yl)-1,3-thiazolidin-4-one (CID 10521764) is 3-(4-benzoylphenyl)-2-(furan-2-yl)-1,3-thiazolidin-4-one.
What is the SMILES notation for 3-(4-benzoylphenyl)-2-(furan-2-yl)-1,3-thiazolidin-4-one?
The canonical SMILES for 3-(4-benzoylphenyl)-2-(furan-2-yl)-1,3-thiazolidin-4-one is O=C(c1ccccc1)c1ccc(N2C(=O)CSC2c2ccco2)cc1.
What is the InChIKey of 3-(4-benzoylphenyl)-2-(furan-2-yl)-1,3-thiazolidin-4-one?
The InChIKey is UASOPGHRCCUKQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15NO3S/c22-18-13-25-20(17-7-4-12-24-17)21(18)16-10-8-15(9-11-16)19(23)14-5-2-1-3-6-14/h1-12,20H,13H2.
What are the key properties of 3-(4-benzoylphenyl)-2-(furan-2-yl)-1,3-thiazolidin-4-one?
3-(4-benzoylphenyl)-2-(furan-2-yl)-1,3-thiazolidin-4-one has a molecular weight of 349.41 g/mol, XLogP of 4.29, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-benzoylphenyl)-2-(furan-2-yl)-1,3-thiazolidin-4-one is sourced from PubChem (CID 10521764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).