1,2,4-Triazine-3,5(2H,4H)-dithione
TL;DR: 1,2,4-Triazine-3,5(2H,4H)-dithione (CAS 461-90-5) is a chemical compound with molecular formula C3H3N3S2 and molecular weight 144.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2H-1,2,4-triazine-3,5-dithione
Also Known As: 1,2,4-triazine-3,5-dithiol, 1,2,4-Triazine-3,5(2H,4H)-dithione, [1,2,4]Triazine-3,5-dithiol, 2H-1,2,4-triazine-3,5-dithione, 1,2,4-Triazine-3,5-bisthiol
| Molecular Formula | C3H3N3S2 |
|---|---|
| Molecular Weight | 144.98 g/mol |
| LogP | 1.19678 |
| Topological Polar Surface Area | 44.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 144.97684 |
| Heavy Atoms | 8 |
| Complexity | 246.85217 |
Chemical Identifiers
| CAS Number | 461-90-5 |
|---|---|
| SMILES | C1=NNC(=S)NC1=S |
Product Overview
1,2,4-Triazine-3,5(2H,4H)-dithione (CAS 461-90-5), with molecular formula C3H3N3S2 and molecular weight 144.98 g/mol. IUPAC: 2H-1,2,4-triazine-3,5-dithione.
Chemical Property Profile of 1,2,4-Triazine-3,5(2H,4H)-dithione
Property Insights of 1,2,4-Triazine-3,5(2H,4H)-dithione
The XLogP value of 1.19678 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,4-Triazine-3,5(2H,4H)-dithione. With a topological polar surface area (TPSA) of 44.47 Ų, 1,2,4-Triazine-3,5(2H,4H)-dithione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,4-Triazine-3,5(2H,4H)-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 1,2,4-Triazine-3,5(2H,4H)-dithione?
The CAS number of 1,2,4-Triazine-3,5(2H,4H)-dithione is 461-90-5.
What is the molecular formula of 1,2,4-Triazine-3,5(2H,4H)-dithione?
The molecular formula of 1,2,4-Triazine-3,5(2H,4H)-dithione is C3H3N3S2.
What is the molecular weight of 1,2,4-Triazine-3,5(2H,4H)-dithione?
The molecular weight of 1,2,4-Triazine-3,5(2H,4H)-dithione is 144.98 g/mol.
Where can I buy 1,2,4-Triazine-3,5(2H,4H)-dithione?
You can request a quote for 1,2,4-Triazine-3,5(2H,4H)-dithione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,4-Triazine-3,5(2H,4H)-dithione?
Yes, KEHONG BIO provides custom synthesis services for 1,2,4-Triazine-3,5(2H,4H)-dithione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.