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3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one structure
Fine Chemical

3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one

TL;DR: 3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one (CAS 166442-70-2) is a chemical compound with molecular formula C13H16N2OS2 and molecular weight 280.0704 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-[4-(diethylamino)phenyl]-2-sulfanylidene-1,3-thiazolidin-4-one

Also Known As: BAS 01074101, 3-[4-(diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one, 3-[4-(Diethylamino)phenyl]-2-thioxo-4-thiazolidinone, 3-(4-Diethylamino-phenyl)-2-thioxo-thiazolidin-4-one, 3-[4-(diethylamino)phenyl]-2-sulfanylidene-1,3-thiazolidin-4-one

CAS Number
166442-70-2
Molecular Formula
C13H16N2OS2
Molecular Weight
280.0704 g/mol
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Technical Specifications

Molecular FormulaC13H16N2OS2
Molecular Weight280.0704 g/mol
XLogP3.3
Topological Polar Surface Area (TPSA)80.9 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds4
Exact Mass280.0704 Da
Heavy Atoms18
Complexity323.0
SMILESCCN(CC)C1=CC=C(C=C1)N2C(=O)CSC2=S
InChIKeyUTPMMNARSXJYOB-UHFFFAOYSA-N

Chemical Property Profile of 3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one

XLogP
3.3
TPSA (Topological Polar Surface Area)
80.9
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
4
Heavy Atoms
18
Complexity
323.0
Exact Mass
280.0704
Monoisotopic Mass
280.0704
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one

The XLogP value of 3.3 indicates that 3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one. Following Lipinski's Rule of Five, 3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one?

The CAS number of 3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one is 166442-70-2.

What is the molecular formula of 3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one?

The molecular formula of 3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one is C13H16N2OS2.

What is the molecular weight of 3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one?

The molecular weight of 3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one is 280.0704 g/mol.

Where can I buy 3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one?

You can request a quote for 3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one?

Yes, CoreyChem provides custom synthesis services for 3-[4-(Diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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