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

C14H11ClN2OS — CID 2731884

IUPAC3-(4-chlorophenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2cccnc2)N1c1ccc(Cl)cc1
InChIInChI=1S/C14H11ClN2OS/c15-11-3-5-12(6-4-11)17-13(18)9-19-14(17)10-2-1-7-16-8-10/h1-8,14H,9H2
InChIKeyBMJBELLWVIGIMS-UHFFFAOYSA-N
MW290.78 g/mol
LogP3.51
Rot. Bonds2

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

3-(4-chlorophenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one (PubChem CID 2731884) has the molecular formula C14H11ClN2OS and a molecular weight of 290.78 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name3-(4-chlorophenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one
PubChem CID2731884
Molecular FormulaC14H11ClN2OS
Molecular Weight290.78 g/mol
Exact Mass290.03
IUPAC Name3-(4-chlorophenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2cccnc2)N1c1ccc(Cl)cc1
InChIInChI=1S/C14H11ClN2OS/c15-11-3-5-12(6-4-11)17-13(18)9-19-14(17)10-2-1-7-16-8-10/h1-8,14H,9H2
InChIKeyBMJBELLWVIGIMS-UHFFFAOYSA-N
XLogP3.51
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.78
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-Phenyl-2-(3-pyridyl)-1,3-thiazolan-4-one
CID 2731886
3-[4-(Tert-butyl)phenyl]-2-(3-pyridyl)-1,3-thiazolan-4-one
CID 2731891
3-(3,4-Dichlorobenzyl)-2-(3-pyridyl)-1,3-thiazolan-4-one
CID 2732022
3-(Cyclopropylmethyl)-2-(3-pyridyl)-1,3-thiazolan-4-one
CID 2732306
3-(4-Chlorophenylthio)-1-(pyridin-4-ylmethyl)pyrrolidine-2,5-dione
CID 2825946
3-(3-Chlorophenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one
CID 3293548
3-(4-Chlorobenzyl)-2-(3-pyridyl)-1,3-thiazolan-4-one
CID 2731954
2-[(4-Chlorophenyl)imino]-3-(3-pyridinylmethyl)-1,3-thiazolan-4-one
CID 2731366
3-(2-Chloro-4-methylphenyl)-2-(3-pyridinyl)-1,3-thiazolan-4-one
CID 2732055
3-(3-Chlorophenyl)-2-pyridin-2-yl-1,3-thiazolidin-4-one
CID 3239346
3-(2,4-Dichlorophenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one
CID 2731946
3-Phenyl-2-pyridin-2-yl-1,3-thiazolidin-4-one
CID 3237434

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one?
The IUPAC name of 3-(4-chlorophenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one (CID 2731884) is 3-(4-chlorophenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one.
What is the SMILES notation for 3-(4-chlorophenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one?
The canonical SMILES for 3-(4-chlorophenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one is O=C1CSC(c2cccnc2)N1c1ccc(Cl)cc1.
What is the InChIKey of 3-(4-chlorophenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one?
The InChIKey is BMJBELLWVIGIMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2OS/c15-11-3-5-12(6-4-11)17-13(18)9-19-14(17)10-2-1-7-16-8-10/h1-8,14H,9H2.
What are the key properties of 3-(4-chlorophenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one?
3-(4-chlorophenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one has a molecular weight of 290.78 g/mol, XLogP of 3.51, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one is sourced from PubChem (CID 2731884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).