3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione
TL;DR: 3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione (CAS 780792-40-7) is a chemical compound with molecular formula C7H6N4S2 and molecular weight 210.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-5-pyrazin-2-yl-1,3,4-thiadiazole-2-thione
Also Known As: 3-methyl-5-pyrazin-2-yl-1,3,4-thiadiazole-2-thione, 3-methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione, 1,3,4-Thiadiazole-2(3H)-thione, 3-methyl-5-pyrazinyl- (9CI)
| Molecular Formula | C7H6N4S2 |
|---|---|
| Molecular Weight | 210.00 g/mol |
| LogP | 1.66809 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.00339 |
| Heavy Atoms | 13 |
| Complexity | 458.84482 |
Chemical Identifiers
| CAS Number | 780792-40-7 |
|---|---|
| SMILES | CN1C(=S)SC(=N1)C2=NC=CN=C2 |
Product Overview
3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione (CAS 780792-40-7), with molecular formula C7H6N4S2 and molecular weight 210.00 g/mol. IUPAC: 3-methyl-5-pyrazin-2-yl-1,3,4-thiadiazole-2-thione.
Chemical Property Profile of 3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione
Property Insights of 3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione
The XLogP value of 1.66809 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione. With a topological polar surface area (TPSA) of 43.6 Ų, 3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione has 0 hydrogen bond donor(s) and 5 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 3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione?
The CAS number of 3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione is 780792-40-7.
What is the molecular formula of 3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione?
The molecular formula of 3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione is C7H6N4S2.
What is the molecular weight of 3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione?
The molecular weight of 3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione is 210.00 g/mol.
Where can I buy 3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione?
You can request a quote for 3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-5-pyrazin-2-yl-1,3,4-thiadiazoline-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.