1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea
TL;DR: 1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea (CAS 13238-64-7) is a chemical compound with molecular formula C10H9N3O2S2 and molecular weight 267.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-3-phenylurea
Also Known As: (3-phenylethynyl)pyridine, 1-(4-Oxo-2-thioxothiazolidin-3-yl)-3-phenylurea, 1-(4-oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea, 3-(4-OXO-2-SULFANYLIDENE-1,3-THIAZOLIDIN-3-YL)-1-PHENYLUREA, 1-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-3-phenylurea
| Molecular Formula | C10H9N3O2S2 |
|---|---|
| Molecular Weight | 267.01 g/mol |
| LogP | 1.5834 |
| Topological Polar Surface Area | 61.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.0136 |
| Heavy Atoms | 17 |
| Complexity | 447.87863 |
Chemical Identifiers
| CAS Number | 13238-64-7 |
|---|---|
| SMILES | C1C(=O)N(C(=S)S1)NC(=O)NC2=CC=CC=C2 |
Product Overview
1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea (CAS 13238-64-7), with molecular formula C10H9N3O2S2 and molecular weight 267.01 g/mol. IUPAC: 1-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-3-phenylurea.
Chemical Property Profile of 1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea
Property Insights of 1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea
The XLogP value of 1.5834 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea. The TPSA of 61.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea. Following Lipinski's Rule of Five, 1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea?
The CAS number of 1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea is 13238-64-7.
What is the molecular formula of 1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea?
The molecular formula of 1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea is C10H9N3O2S2.
What is the molecular weight of 1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea?
The molecular weight of 1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea is 267.01 g/mol.
Where can I buy 1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea?
You can request a quote for 1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.