3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide
TL;DR: 3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide (CAS 15001-11-3) is a chemical compound with molecular formula C16H14N2O2S and molecular weight 298.0776 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,6-diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide
Also Known As: 3,6-diphenyl-2,7-dihydro-1, 3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide, 1,4,5-THIADIAZEPINE, 2,7-DIHYDRO-3,6-DIPHENYL-, 1,1-DIOXIDE, 1,4,5-Thiadiazepine,2,7-dihydro-3,6-diphenyl-, 1,1-dioxide, [1,4,5]Thiadiazepine, 3,6-diphenyl-2,7-dihydro-, 1,1-dioxide
Technical Specifications
| Molecular Formula | C16H14N2O2S |
| Molecular Weight | 298.0776 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 67.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 298.0776 Da |
| Heavy Atoms | 21 |
| Complexity | 477.0 |
| SMILES | C1C(=NN=C(CS1(=O)=O)C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | NHZMERSIZAOIPM-UHFFFAOYSA-N |
Chemical Property Profile of 3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide
Property Insights of 3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide. Following Lipinski's Rule of Five, 3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide has 0 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 3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide?
The CAS number of 3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide is 15001-11-3.
What is the molecular formula of 3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide?
The molecular formula of 3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide is C16H14N2O2S.
What is the molecular weight of 3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide?
The molecular weight of 3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide is 298.0776 g/mol.
Where can I buy 3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide?
You can request a quote for 3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide?
Yes, CoreyChem provides custom synthesis services for 3,6-Diphenyl-2,7-dihydro-1,4,5-thiadiazepine 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.