2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one

C14H12N2OS — CID 2731887

IUPAC2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2ccccc2)N1c1cccnc1
InChIInChI=1S/C14H12N2OS/c17-13-10-18-14(11-5-2-1-3-6-11)16(13)12-7-4-8-15-9-12/h1-9,14H,10H2
InChIKeyXAAUFTBSBLWSOW-UHFFFAOYSA-N
MW256.33 g/mol
LogP2.86
Rot. Bonds2

About 2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one

2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one (PubChem CID 2731887) has the molecular formula C14H12N2OS and a molecular weight of 256.33 g/mol. Its IUPAC name is 2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one
PubChem CID2731887
Molecular FormulaC14H12N2OS
Molecular Weight256.33 g/mol
Exact Mass256.07
IUPAC Name2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2ccccc2)N1c1cccnc1
InChIInChI=1S/C14H12N2OS/c17-13-10-18-14(11-5-2-1-3-6-11)16(13)12-7-4-8-15-9-12/h1-9,14H,10H2
InChIKeyXAAUFTBSBLWSOW-UHFFFAOYSA-N
XLogP2.86
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-3-[4-[(2S)-4-oxo-2-phenyl-1,3-thiazolidin-3-yl]phenyl]-2-phenyl-1,3-thiazolidin-4-one
CID 1041463
3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one
CID 13304116
3-(4-cyclohexylphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one
CID 2732157
3-(4-nitrophenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one
CID 13304122
(2S)-3-(4-phenoxyphenyl)-2-phenyl-1,3-thiazolidin-4-one
CID 6935175
3-(4-bromo-3-methylphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one
CID 2826305
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
2-(4-methoxyphenyl)-3-phenyl-1,3-thiazolidin-4-one
CID 2839840
2-(4-methylsulfanylphenyl)-3-phenyl-1,3-thiazolidin-4-one
CID 5080347
3-(4-ethylphenyl)-2-phenyl-1,3-thiazolidin-4-one
CID 53497781
3-[4-(imidazol-1-ylmethyl)phenyl]-2-phenyl-1,3-thiazolidin-4-one
CID 102288238

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one?
The IUPAC name of 2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one (CID 2731887) is 2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one?
The canonical SMILES for 2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one is O=C1CSC(c2ccccc2)N1c1cccnc1.
What is the InChIKey of 2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one?
The InChIKey is XAAUFTBSBLWSOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2OS/c17-13-10-18-14(11-5-2-1-3-6-11)16(13)12-7-4-8-15-9-12/h1-9,14H,10H2.
What are the key properties of 2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one?
2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one has a molecular weight of 256.33 g/mol, XLogP of 2.86, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one is sourced from PubChem (CID 2731887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).