![5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione structure](/static/products/857/857041-68-0.png)
5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione
TL;DR: 5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione (CAS 857041-68-0) is a chemical compound with molecular formula C13H12N2O2S and molecular weight 260.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-5-(phenyliminomethyl)-3-prop-2-enyl-1,3-thiazol-2-one
Also Known As: 5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione, 5-(anilinomethylidene)-3-prop-2-enyl-1,3-thiazolidine-2,4-dione, (5Z)-5-(anilinomethylidene)-3-prop-2-enyl-1,3-thiazolidine-2,4-dione, 5-(Anilinomethylidene)-3-(prop-2-en-1-yl)-1,3-thiazolidine-2,4-dione, 5-[(phenylamino)methylene]-3-prop-2-enyl-1,3-thiazolidine-2,4-dione
| Molecular Formula | C13H12N2O2S |
|---|---|
| Molecular Weight | 260.06 g/mol |
| LogP | 2.552 |
| Topological Polar Surface Area | 54.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.06195 |
| Heavy Atoms | 18 |
| Complexity | 626.186 |
Chemical Identifiers
| CAS Number | 857041-68-0 |
|---|---|
| SMILES | C=CCN1C(=C(SC1=O)C=NC2=CC=CC=C2)O |
Product Overview
5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione (CAS 857041-68-0), with molecular formula C13H12N2O2S and molecular weight 260.06 g/mol. IUPAC: 4-hydroxy-5-(phenyliminomethyl)-3-prop-2-enyl-1,3-thiazol-2-one.
Chemical Property Profile of 5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione
Property Insights of 5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione
The XLogP value of 2.552 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione. With a topological polar surface area (TPSA) of 54.59 Ų, 5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione has 1 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 5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione?
The CAS number of 5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione is 857041-68-0.
What is the molecular formula of 5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione?
The molecular formula of 5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione is C13H12N2O2S.
What is the molecular weight of 5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione?
The molecular weight of 5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione is 260.06 g/mol.
Where can I buy 5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione?
You can request a quote for 5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(Phenylamino)methylene]-3-(2-propen-1-yl)-2,4-thiazolidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.