3-(4-methylphenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one

C14H13NOS2 — CID 2999563

IUPAC3-(4-methylphenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one
SMILESCc1ccc(N2C(=O)CSC2c2cccs2)cc1
InChIInChI=1S/C14H13NOS2/c1-10-4-6-11(7-5-10)15-13(16)9-18-14(15)12-3-2-8-17-12/h2-8,14H,9H2,1H3
InChIKeyAPKXDQPJBFUYRN-UHFFFAOYSA-N
MW275.40 g/mol
LogP3.84
Rot. Bonds2

About 3-(4-methylphenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one

3-(4-methylphenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one (PubChem CID 2999563) has the molecular formula C14H13NOS2 and a molecular weight of 275.40 g/mol. Its IUPAC name is 3-(4-methylphenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name3-(4-methylphenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one
PubChem CID2999563
Molecular FormulaC14H13NOS2
Molecular Weight275.40 g/mol
Exact Mass275.04
IUPAC Name3-(4-methylphenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one
SMILESCc1ccc(N2C(=O)CSC2c2cccs2)cc1
InChIInChI=1S/C14H13NOS2/c1-10-4-6-11(7-5-10)15-13(16)9-18-14(15)12-3-2-8-17-12/h2-8,14H,9H2,1H3
InChIKeyAPKXDQPJBFUYRN-UHFFFAOYSA-N
XLogP3.84
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-(4-methylphenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(4-methylphenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one?
The IUPAC name of 3-(4-methylphenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one (CID 2999563) is 3-(4-methylphenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one.
What is the SMILES notation for 3-(4-methylphenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one?
The canonical SMILES for 3-(4-methylphenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one is Cc1ccc(N2C(=O)CSC2c2cccs2)cc1.
What is the InChIKey of 3-(4-methylphenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one?
The InChIKey is APKXDQPJBFUYRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NOS2/c1-10-4-6-11(7-5-10)15-13(16)9-18-14(15)12-3-2-8-17-12/h2-8,14H,9H2,1H3.
What are the key properties of 3-(4-methylphenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one?
3-(4-methylphenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one has a molecular weight of 275.40 g/mol, XLogP of 3.84, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylphenyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one is sourced from PubChem (CID 2999563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).