5-Isopropylidene-thiazolidine-2,4-dione
TL;DR: 5-Isopropylidene-thiazolidine-2,4-dione (CAS 5835-47-2) is a chemical compound with molecular formula C6H7NO2S and molecular weight 157.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-propan-2-ylidene-1,3-thiazolidine-2,4-dione
Also Known As: 5-isopropylidene-thiazolidine-2,4-dione, 2,4-Thiazolidinedione, 5-isopropylidene, 5-(propan-2-ylidene)thiazolidine-2,4-dione, 5-propan-2-ylidene-1,3-thiazolidine-2,4-dione, 5-isopropylidene-1,3-thiazolidine-2,4-dione
| Molecular Formula | C6H7NO2S |
|---|---|
| Molecular Weight | 157.02 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 71.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 157.01974 |
| Heavy Atoms | 10 |
| Complexity | 228.0 |
Chemical Identifiers
| CAS Number | 5835-47-2 |
|---|---|
| SMILES | CC(=C1C(=O)NC(=O)S1)C |
| InChIKey | QOWVABKYNPDNIM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Isopropylidene-thiazolidine-2,4-dione (CAS 5835-47-2), with molecular formula C6H7NO2S and molecular weight 157.02 g/mol. IUPAC: 5-propan-2-ylidene-1,3-thiazolidine-2,4-dione.
Chemical Property Profile of 5-Isopropylidene-thiazolidine-2,4-dione
Property Insights of 5-Isopropylidene-thiazolidine-2,4-dione
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Isopropylidene-thiazolidine-2,4-dione. The TPSA of 71.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Isopropylidene-thiazolidine-2,4-dione. Following Lipinski's Rule of Five, 5-Isopropylidene-thiazolidine-2,4-dione 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 5-Isopropylidene-thiazolidine-2,4-dione?
The CAS number of 5-Isopropylidene-thiazolidine-2,4-dione is 5835-47-2.
What is the molecular formula of 5-Isopropylidene-thiazolidine-2,4-dione?
The molecular formula of 5-Isopropylidene-thiazolidine-2,4-dione is C6H7NO2S.
What is the molecular weight of 5-Isopropylidene-thiazolidine-2,4-dione?
The molecular weight of 5-Isopropylidene-thiazolidine-2,4-dione is 157.02 g/mol.
Where can I buy 5-Isopropylidene-thiazolidine-2,4-dione?
You can request a quote for 5-Isopropylidene-thiazolidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Isopropylidene-thiazolidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Isopropylidene-thiazolidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.