![8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione structure](/static/products/6975/69754-54-7.webp)
8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione
TL;DR: 8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione (CAS 69754-54-7) is a chemical compound with molecular formula C7H8N4S2 and molecular weight 212.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione
Also Known As: 8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione, 2,3,8,9-Tetrahydro-5H-diimidazo[2,1-b:2',1'-d][1,3,5]thiadiazine-5-thione
| Molecular Formula | C7H8N4S2 |
|---|---|
| Molecular Weight | 212.02 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 88.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 212.01904 |
| Heavy Atoms | 13 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 69754-54-7 |
|---|---|
| SMILES | C1CN2C(=N1)N3CCN=C3SC2=S |
| InChIKey | ZWNDTKNJNLKCIA-UHFFFAOYSA-N |
Product Overview
8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione (CAS 69754-54-7), with molecular formula C7H8N4S2 and molecular weight 212.02 g/mol. IUPAC: 8-thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione.
Chemical Property Profile of 8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione
Property Insights of 8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione. The TPSA of 88.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione. Following Lipinski's Rule of Five, 8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione 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
Frequently Asked Questions
What is the CAS number of 8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione?
The CAS number of 8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione is 69754-54-7.
What is the molecular formula of 8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione?
The molecular formula of 8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione is C7H8N4S2.
What is the molecular weight of 8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione?
The molecular weight of 8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione is 212.02 g/mol.
Where can I buy 8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione?
You can request a quote for 8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione?
Yes, KEHONG BIO provides custom synthesis services for 8-Thia-1,3,6,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,9-diene-7-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.