2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one

C14H11Cl2N3OS — CID 57390348

IUPAC2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one
SMILESCc1cccc(N2C(=O)CSC2c2c(Cl)cncc2Cl)n1
InChIInChI=1S/C14H11Cl2N3OS/c1-8-3-2-4-11(18-8)19-12(20)7-21-14(19)13-9(15)5-17-6-10(13)16/h2-6,14H,7H2,1H3
InChIKeyIECKWJKZQJDEOK-UHFFFAOYSA-N
MW340.24 g/mol
LogP3.87
Rot. Bonds2

About 2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one

2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one (PubChem CID 57390348) has the molecular formula C14H11Cl2N3OS and a molecular weight of 340.24 g/mol. Its IUPAC name is 2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one
PubChem CID57390348
Molecular FormulaC14H11Cl2N3OS
Molecular Weight340.24 g/mol
Exact Mass339.00
IUPAC Name2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one
SMILESCc1cccc(N2C(=O)CSC2c2c(Cl)cncc2Cl)n1
InChIInChI=1S/C14H11Cl2N3OS/c1-8-3-2-4-11(18-8)19-12(20)7-21-14(19)13-9(15)5-17-6-10(13)16/h2-6,14H,7H2,1H3
InChIKeyIECKWJKZQJDEOK-UHFFFAOYSA-N
XLogP3.87
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.24
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one
CID 513677
2-(2,6-dimethylphenyl)-3-(4,6-dimethyl-2-pyridinyl)-1,3-thiazolidin-4-one
CID 513686
2-(2,6-dichlorophenyl)-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1,3-thiazolidin-4-one
CID 16728005
2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one
CID 16728779
2-(2,6-dichlorophenyl)-3-(3,5-dichlorophenyl)-1,3-thiazolidin-4-one
CID 503758
3-(6-bromo-2-pyridinyl)-2-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one
CID 513683
2-(2,6-dichlorophenyl)-3-[6-oxo-4-(trifluoromethyl)-1H-pyrimidin-2-yl]-1,3-thiazolidin-4-one
CID 135585392
3-(6-bromo-2-pyridinyl)-2-(2-fluoro-6-methoxyphenyl)-1,3-thiazolidin-4-one
CID 513682
2-(2,6-dimethoxyphenyl)-3-(4-methylpyrimidin-2-yl)-1,3-thiazolidin-4-one
CID 513696
2-(2-chloro-6-fluorophenyl)-3-(4-methoxy-6-methylpyrimidin-2-yl)-1,3-thiazolidin-4-one
CID 3012196
2-(2,6-dichlorophenyl)-3-(4-methoxy-1,3-benzothiazol-2-yl)-1,3-thiazolidin-4-one
CID 71521936
(2R)-2-(3-chlorophenyl)-3-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazolidin-4-one
CID 27879726

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one?
The IUPAC name of 2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one (CID 57390348) is 2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one?
The canonical SMILES for 2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one is Cc1cccc(N2C(=O)CSC2c2c(Cl)cncc2Cl)n1.
What is the InChIKey of 2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one?
The InChIKey is IECKWJKZQJDEOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2N3OS/c1-8-3-2-4-11(18-8)19-12(20)7-21-14(19)13-9(15)5-17-6-10(13)16/h2-6,14H,7H2,1H3.
What are the key properties of 2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one?
2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one has a molecular weight of 340.24 g/mol, XLogP of 3.87, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one is sourced from PubChem (CID 57390348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).