3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one

C15H14N2O2S — CID 13304116

IUPAC3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one
SMILESCOc1ccc(N2C(=O)CSC2c2cccnc2)cc1
InChIInChI=1S/C15H14N2O2S/c1-19-13-6-4-12(5-7-13)17-14(18)10-20-15(17)11-3-2-8-16-9-11/h2-9,15H,10H2,1H3
InChIKeyLDOWHIQVJKFSRZ-UHFFFAOYSA-N
MW286.36 g/mol
LogP2.87
Rot. Bonds3

About 3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one

3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one (PubChem CID 13304116) has the molecular formula C15H14N2O2S and a molecular weight of 286.36 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one
PubChem CID13304116
Molecular FormulaC15H14N2O2S
Molecular Weight286.36 g/mol
Exact Mass286.08
IUPAC Name3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one
SMILESCOc1ccc(N2C(=O)CSC2c2cccnc2)cc1
InChIInChI=1S/C15H14N2O2S/c1-19-13-6-4-12(5-7-13)17-14(18)10-20-15(17)11-3-2-8-16-9-11/h2-9,15H,10H2,1H3
InChIKeyLDOWHIQVJKFSRZ-UHFFFAOYSA-N
XLogP2.87
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-3-[(4-methoxyphenyl)methyl]-2-pyridin-3-yl-1,3-thiazolidin-4-one
CID 6925536
(2R)-3-(4-methoxyphenyl)-2-(4-phenoxyphenyl)-1,3-thiazolidin-4-one
CID 1274265
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
2-(4-methoxyphenyl)-3-phenyl-1,3-thiazolidin-4-one
CID 2839840
3-(4-bromo-3-methylphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one
CID 2826305
3-(4-bromophenyl)-2-(4-methoxyphenyl)-1,3-thiazolidin-4-one
CID 3858882
3-(4-iodophenyl)-2-(4-methoxyphenyl)-1,3-thiazolidin-4-one
CID 17384306
2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one
CID 2731887
(2S)-3-(4-phenoxyphenyl)-2-phenyl-1,3-thiazolidin-4-one
CID 6935175
(2S)-3-(3,4-dichlorophenyl)-2-(4-methoxyphenyl)-1,3-thiazolidin-4-one
CID 1274540
(2S)-3-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-3-yl-1,3-thiazolidin-4-one
CID 6925144

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one?
The IUPAC name of 3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one (CID 13304116) is 3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one.
What is the SMILES notation for 3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one?
The canonical SMILES for 3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one is COc1ccc(N2C(=O)CSC2c2cccnc2)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one?
The InChIKey is LDOWHIQVJKFSRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2S/c1-19-13-6-4-12(5-7-13)17-14(18)10-20-15(17)11-3-2-8-16-9-11/h2-9,15H,10H2,1H3.
What are the key properties of 3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one?
3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one has a molecular weight of 286.36 g/mol, XLogP of 2.87, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one is sourced from PubChem (CID 13304116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).