4-(3,4,5-Trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide
TL;DR: 4-(3,4,5-Trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide (CAS 120991-26-6) is a chemical compound with molecular formula C11H15N3O5S and molecular weight 301.07324 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,1-dioxo-3-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,2,5-thiadiazol-4-amine
Also Known As: 1,1-dioxo-3-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,2,5-thiadiazol-4-amine, 4-(3,4,5-trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide, 3-imino-4-(3,4,5-trimethoxyphenyl)-1,2,5-thiadiazolidine 1,1-dioxide, 1,1-dioxo-4-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1,2,5-thiadiazol-3-amine
Technical Specifications
| Molecular Formula | C11H15N3O5S |
| Molecular Weight | 301.07324 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 121.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.07324 Da |
| Heavy Atoms | 20 |
| Complexity | 461.0 |
| SMILES | COC1=CC(=CC(=C1OC)OC)C2C(=NS(=O)(=O)N2)N |
| InChIKey | DCNFRNJKDAQOCB-UHFFFAOYSA-N |
Chemical Property Profile of 4-(3,4,5-Trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide
Property Insights of 4-(3,4,5-Trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide
The XLogP value of -0.1 indicates that 4-(3,4,5-Trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3,4,5-Trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide. Following Lipinski's Rule of Five, 4-(3,4,5-Trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(3,4,5-Trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide?
The CAS number of 4-(3,4,5-Trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide is 120991-26-6.
What is the molecular formula of 4-(3,4,5-Trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide?
The molecular formula of 4-(3,4,5-Trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide is C11H15N3O5S.
What is the molecular weight of 4-(3,4,5-Trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide?
The molecular weight of 4-(3,4,5-Trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide is 301.07324 g/mol.
Where can I buy 4-(3,4,5-Trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide?
You can request a quote for 4-(3,4,5-Trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(3,4,5-Trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide?
Yes, CoreyChem provides custom synthesis services for 4-(3,4,5-Trimethoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.