3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine
TL;DR: 3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine (CAS 10179-85-8) is a chemical compound with molecular formula C5H5N5 and molecular weight 135.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyltriazolo[4,5-d]pyrimidine
Also Known As: 3-Methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidine, 9-methyl-8-azapurine, 3-methyltriazolo[4,5-d]pyrimidine, 3-Methyl-3H-1,2,3-triazolo[4,5-d]pyrimidine, 3H-1,2,3-Triazolo[4,5-d]pyrimidine, 3-methyl- (9CI)
| Molecular Formula | C5H5N5 |
|---|---|
| Molecular Weight | 135.05 g/mol |
| LogP | -0.2417 |
| Topological Polar Surface Area | 56.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 135.05449 |
| Heavy Atoms | 10 |
| Complexity | 351.5658 |
Chemical Identifiers
| CAS Number | 10179-85-8 |
|---|---|
| SMILES | CN1C2=NC=NC=C2N=N1 |
Product Overview
3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine (CAS 10179-85-8), with molecular formula C5H5N5 and molecular weight 135.05 g/mol. IUPAC: 3-methyltriazolo[4,5-d]pyrimidine.
Chemical Property Profile of 3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine
Property Insights of 3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine
The XLogP value of -0.2417 indicates that 3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 56.49 Ų, 3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine 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 3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine?
The CAS number of 3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine is 10179-85-8.
What is the molecular formula of 3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine?
The molecular formula of 3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine is C5H5N5.
What is the molecular weight of 3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine?
The molecular weight of 3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine is 135.05 g/mol.
Where can I buy 3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine?
You can request a quote for 3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-3H-1,2,3-triazolo(4,5-d)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.