![1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione structure](/static/products/7797/77976-34-2.webp)
1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione
TL;DR: 1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione (CAS 77976-34-2) is a chemical compound with molecular formula C5H7N5S and molecular weight 169.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione
Also Known As: 1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione, 1-Methyl-1,4,6,7-tetrahydro-5H-[1,2,3]triazolo[4,5-d]pyrimidine-5-thione, 5H-1,2,3-Triazolo[4,5-d]pyrimidine-5-thione, 1,4,6, 7-tetrahydro-1-methyl-, 5H-1,2,3-Triazolo[4,5-d]pyrimidine-5-thione, 1,4,6,7-tetrahydro-1-methyl-, 5H-1,3-Triazolo[4,5-d]pyrimidine-5-thione, 1,4,6,7-tetrahydro-1-methyl-
| Molecular Formula | C5H7N5S |
|---|---|
| Molecular Weight | 169.04 g/mol |
| LogP | -0.3849 |
| Topological Polar Surface Area | 54.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 169.04222 |
| Heavy Atoms | 11 |
| Complexity | 303.82147 |
Chemical Identifiers
| CAS Number | 77976-34-2 |
|---|---|
| SMILES | CN1C2=C(NC(=S)NC2)N=N1 |
Product Overview
1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione (CAS 77976-34-2), with molecular formula C5H7N5S and molecular weight 169.04 g/mol. IUPAC: 1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione.
Chemical Property Profile of 1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione
Property Insights of 1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione
The XLogP value of -0.3849 indicates that 1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 54.77 Ų, 1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione 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-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione?
The CAS number of 1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione is 77976-34-2.
What is the molecular formula of 1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione?
The molecular formula of 1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione is C5H7N5S.
What is the molecular weight of 1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione?
The molecular weight of 1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione is 169.04 g/mol.
Where can I buy 1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione?
You can request a quote for 1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione?
Yes, KEHONG BIO provides custom synthesis services for 1-methyl-6,7-dihydro-4H-triazolo[4,5-d]pyrimidine-5-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.