3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine
TL;DR: 3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine (CAS 106580-71-6) is a chemical compound with molecular formula C8H10N6 and molecular weight 190.0967 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine
Also Known As: 3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine, 5-amino-3-(pyridin-2-ylmethylamino)-1H-1,2,4-triazole, N5-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine
Technical Specifications
| Molecular Formula | C8H10N6 |
| Molecular Weight | 190.0967 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 92.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 190.0967 Da |
| Heavy Atoms | 14 |
| Complexity | 175.0 |
| SMILES | C1=CC=NC(=C1)CNC2=NNC(=N2)N |
| InChIKey | BZSQQLRJLYADLW-UHFFFAOYSA-N |
Chemical Property Profile of 3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine
Property Insights of 3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine. The TPSA of 92.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine. Following Lipinski's Rule of Five, 3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine?
The CAS number of 3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine is 106580-71-6.
What is the molecular formula of 3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine?
The molecular formula of 3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine is C8H10N6.
What is the molecular weight of 3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine?
The molecular weight of 3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine is 190.0967 g/mol.
Where can I buy 3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine?
You can request a quote for 3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine?
Yes, CoreyChem provides custom synthesis services for 3-N-(pyridin-2-ylmethyl)-1H-1,2,4-triazole-3,5-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.