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

C19H15ClN2O2S — CID 11100740

IUPAC2-(2-chloroquinolin-3-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one
SMILESCOc1ccc(N2C(=O)CSC2c2cc3ccccc3nc2Cl)cc1
InChIInChI=1S/C19H15ClN2O2S/c1-24-14-8-6-13(7-9-14)22-17(23)11-25-19(22)15-10-12-4-2-3-5-16(12)21-18(15)20/h2-10,19H,11H2,1H3
InChIKeyUGEOETXSOIWFMI-UHFFFAOYSA-N
MW370.86 g/mol
LogP4.68
Rot. Bonds3

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

2-(2-chloroquinolin-3-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one (PubChem CID 11100740) has the molecular formula C19H15ClN2O2S and a molecular weight of 370.86 g/mol. Its IUPAC name is 2-(2-chloroquinolin-3-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-(2-chloroquinolin-3-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one
PubChem CID11100740
Molecular FormulaC19H15ClN2O2S
Molecular Weight370.86 g/mol
Exact Mass370.05
IUPAC Name2-(2-chloroquinolin-3-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one
SMILESCOc1ccc(N2C(=O)CSC2c2cc3ccccc3nc2Cl)cc1
InChIInChI=1S/C19H15ClN2O2S/c1-24-14-8-6-13(7-9-14)22-17(23)11-25-19(22)15-10-12-4-2-3-5-16(12)21-18(15)20/h2-10,19H,11H2,1H3
InChIKeyUGEOETXSOIWFMI-UHFFFAOYSA-N
XLogP4.68
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.86
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-(2-chloro-7-methoxyquinolin-3-yl)-3-(2-methoxyphenyl)-1,3-thiazolidin-4-one
CID 10692406
2-(2-chloro-7-methoxyquinolin-3-yl)-3-(2,6-dichlorophenyl)-1,3-thiazolidin-4-one
CID 10252653
2-(2,4-dichlorophenyl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one
CID 4248077
2-(4-methoxyphenyl)-3-phenyl-1,3-thiazolidin-4-one
CID 2839840
(2S)-3-(3,4-dichlorophenyl)-2-(4-methoxyphenyl)-1,3-thiazolidin-4-one
CID 1274540
(2R)-3-(4-methoxyphenyl)-2-(4-phenoxyphenyl)-1,3-thiazolidin-4-one
CID 1274265
2-(2-chloro-7-methoxyquinolin-3-yl)-3-[5-hydroxy-2-[(4-methylphenyl)diazenyl]phenyl]-1,3-thiazolidin-4-one
CID 135954811
3-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidin-4-one
CID 13304116
2-(2-chloroquinolin-3-yl)-3-(6-methoxy-1,3-benzothiazol-2-yl)-5-methyl-1,3-thiazolidin-4-one
CID 52921088
2-[2-hydroxy-5-[(4-methoxyphenyl)diazenyl]phenyl]-3-(4-hydroxyphenyl)-1,3-thiazolidin-4-one
CID 139235926
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

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloroquinolin-3-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one?
The IUPAC name of 2-(2-chloroquinolin-3-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one (CID 11100740) is 2-(2-chloroquinolin-3-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-(2-chloroquinolin-3-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one?
The canonical SMILES for 2-(2-chloroquinolin-3-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one is COc1ccc(N2C(=O)CSC2c2cc3ccccc3nc2Cl)cc1.
What is the InChIKey of 2-(2-chloroquinolin-3-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one?
The InChIKey is UGEOETXSOIWFMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN2O2S/c1-24-14-8-6-13(7-9-14)22-17(23)11-25-19(22)15-10-12-4-2-3-5-16(12)21-18(15)20/h2-10,19H,11H2,1H3.
What are the key properties of 2-(2-chloroquinolin-3-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one?
2-(2-chloroquinolin-3-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one has a molecular weight of 370.86 g/mol, XLogP of 4.68, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloroquinolin-3-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one is sourced from PubChem (CID 11100740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).