Tetrahydro-1,3,6-thiadiazepine-2,7-dithione
TL;DR: Tetrahydro-1,3,6-thiadiazepine-2,7-dithione (CAS 5782-83-2) is a chemical compound with molecular formula C4H6N2S3 and molecular weight 177.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,6-thiadiazepane-2,7-dithione
Also Known As: Endodan, Vegetta, Vegeta, Vegita, 1,3,6-thiadiazepane-2,7-dithione
| Molecular Formula | C4H6N2S3 |
|---|---|
| Molecular Weight | 177.97 g/mol |
| LogP | 0.4822 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 177.96931 |
| Heavy Atoms | 9 |
| Complexity | 128.74817 |
Chemical Identifiers
| CAS Number | 5782-83-2 |
|---|---|
| SMILES | C1CNC(=S)SC(=S)N1 |
Product Overview
Tetrahydro-1,3,6-thiadiazepine-2,7-dithione (CAS 5782-83-2), with molecular formula C4H6N2S3 and molecular weight 177.97 g/mol. IUPAC: 1,3,6-thiadiazepane-2,7-dithione.
Chemical Property Profile of Tetrahydro-1,3,6-thiadiazepine-2,7-dithione
Property Insights of Tetrahydro-1,3,6-thiadiazepine-2,7-dithione
The XLogP value of 0.4822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tetrahydro-1,3,6-thiadiazepine-2,7-dithione. With a topological polar surface area (TPSA) of 24.06 Ų, Tetrahydro-1,3,6-thiadiazepine-2,7-dithione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetrahydro-1,3,6-thiadiazepine-2,7-dithione has 2 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 Tetrahydro-1,3,6-thiadiazepine-2,7-dithione?
The CAS number of Tetrahydro-1,3,6-thiadiazepine-2,7-dithione is 5782-83-2.
What is the molecular formula of Tetrahydro-1,3,6-thiadiazepine-2,7-dithione?
The molecular formula of Tetrahydro-1,3,6-thiadiazepine-2,7-dithione is C4H6N2S3.
What is the molecular weight of Tetrahydro-1,3,6-thiadiazepine-2,7-dithione?
The molecular weight of Tetrahydro-1,3,6-thiadiazepine-2,7-dithione is 177.97 g/mol.
Where can I buy Tetrahydro-1,3,6-thiadiazepine-2,7-dithione?
You can request a quote for Tetrahydro-1,3,6-thiadiazepine-2,7-dithione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrahydro-1,3,6-thiadiazepine-2,7-dithione?
Yes, KEHONG BIO provides custom synthesis services for Tetrahydro-1,3,6-thiadiazepine-2,7-dithione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.