(E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one
TL;DR: (E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one (CAS 444599-31-9) is a chemical compound with molecular formula C14H10N2OS2 and molecular weight 286.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(1-phenylpyrrol-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: (E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one, (5E)-4-hydroxy-5-[(1-phenyl-1H-pyrrol-2-yl)methylidene]-1,3-thiazole-2(5H)-thione, (5E)-5-[(1-phenyl-1H-pyrrol-2-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one, (5E)-5-[(1-phenylpyrrol-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, 5-[(1-phenylpyrrol-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C14H10N2OS2 |
|---|---|
| Molecular Weight | 286.02 g/mol |
| LogP | 2.9661 |
| Topological Polar Surface Area | 34.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.02347 |
| Heavy Atoms | 19 |
| Complexity | 673.7642 |
Chemical Identifiers
| CAS Number | 444599-31-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=CC=C2/C=C/3\C(=O)NC(=S)S3 |
Product Overview
(E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one (CAS 444599-31-9), with molecular formula C14H10N2OS2 and molecular weight 286.02 g/mol. IUPAC: (5E)-5-[(1-phenylpyrrol-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of (E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one
Property Insights of (E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one
The XLogP value of 2.9661 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one. With a topological polar surface area (TPSA) of 34.03 Ų, (E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one has 1 hydrogen bond donor(s) and 3 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 (E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one?
The CAS number of (E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one is 444599-31-9.
What is the molecular formula of (E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one?
The molecular formula of (E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one is C14H10N2OS2.
What is the molecular weight of (E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one?
The molecular weight of (E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one is 286.02 g/mol.
Where can I buy (E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one?
You can request a quote for (E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-((1-phenyl-1H-pyrrol-2-yl)methylene)-2-thioxothiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.