5-(4-Isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione
TL;DR: 5-(4-Isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione (CAS 1008000-53-0) is a chemical compound with molecular formula C13H16N2O2S and molecular weight 264.09326 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(3-methyl-4-propan-2-ylanilino)-1,3-thiazolidine-2,4-dione
Also Known As: 5-(4-isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione, 5-(3-methyl-4-propan-2-ylanilino)-1,3-thiazolidine-2,4-dione, 2,4-Thiazolidinedione, 5-[[3-methyl-4-(1-methylethyl)phenyl]amino]-, 5-((4-Isopropyl-3-methylphenyl)amino)thiazolidine-2,4-dione, 5-{[3-methyl-4-(propan-2-yl)phenyl]amino}-1,3-thiazolidine-2,4-dione
Technical Specifications
| Molecular Formula | C13H16N2O2S |
| Molecular Weight | 264.09326 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 83.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.09326 Da |
| Heavy Atoms | 18 |
| Complexity | 346.0 |
| SMILES | CC1=C(C=CC(=C1)NC2C(=O)NC(=O)S2)C(C)C |
| InChIKey | TYLFKADMZCXUBX-UHFFFAOYSA-N |
Chemical Property Profile of 5-(4-Isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione
Property Insights of 5-(4-Isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione
The XLogP value of 3.4 indicates that 5-(4-Isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-Isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione. Following Lipinski's Rule of Five, 5-(4-Isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione 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
What is the CAS number of 5-(4-Isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione?
The CAS number of 5-(4-Isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione is 1008000-53-0.
What is the molecular formula of 5-(4-Isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione?
The molecular formula of 5-(4-Isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione is C13H16N2O2S.
What is the molecular weight of 5-(4-Isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione?
The molecular weight of 5-(4-Isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione is 264.09326 g/mol.
Where can I buy 5-(4-Isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione?
You can request a quote for 5-(4-Isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(4-Isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione?
Yes, CoreyChem provides custom synthesis services for 5-(4-Isopropyl-3-methylanilino)-1,3-thiazolane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.