N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine
TL;DR: N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine (CAS 106580-72-7) is a chemical compound with molecular formula C8H10N6 and molecular weight 190.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-N-(pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine
Also Known As: Maybridge3_005069, IDI1_016456, 3-N-(pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine, 5-amino-3-(pyridin-3-ylmethylamino)-1H-1,2,4-triazole, N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine
| Molecular Formula | C8H10N6 |
|---|---|
| Molecular Weight | 190.10 g/mol |
| LogP | 0.394 |
| Topological Polar Surface Area | 92.51 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 190.0967 |
| Heavy Atoms | 14 |
| Complexity | 395.22357 |
Chemical Identifiers
| CAS Number | 106580-72-7 |
|---|---|
| SMILES | C1=CC(=CN=C1)CNC2=NNC(=N2)N |
Product Overview
N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine (CAS 106580-72-7), with molecular formula C8H10N6 and molecular weight 190.10 g/mol. IUPAC: 3-N-(pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine.
Chemical Property Profile of N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine
Property Insights of N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine
The XLogP value of 0.394 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine. The TPSA of 92.51 Ų falls within the moderate polarity range, balancing permeability and solubility for N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine. Following Lipinski's Rule of Five, N5-(Pyridin-3-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
Frequently Asked Questions
What is the CAS number of N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine?
The CAS number of N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine is 106580-72-7.
What is the molecular formula of N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine?
The molecular formula of N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine is C8H10N6.
What is the molecular weight of N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine?
The molecular weight of N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine is 190.10 g/mol.
Where can I buy N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine?
You can request a quote for N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine?
Yes, KEHONG BIO provides custom synthesis services for N5-(Pyridin-3-ylmethyl)-1H-1,2,4-triazole-3,5-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.