N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine
TL;DR: N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine (CAS 200431-98-7) is a chemical compound with molecular formula C8H9N5 and molecular weight 175.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine
Also Known As: N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine, NCIStruc1_000250, NCIStruc2_000025, N-(3-pyridinylmethyl)-1H-1,2,4-triazol-3-amine, NCI60_001245
| Molecular Formula | C8H9N5 |
|---|---|
| Molecular Weight | 175.09 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 175.0858 |
| Heavy Atoms | 13 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 200431-98-7 |
|---|---|
| SMILES | C1=CC(=CN=C1)CNC2=NC=NN2 |
| InChIKey | WKJQXLYKOGTVRQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine (CAS 200431-98-7), with molecular formula C8H9N5 and molecular weight 175.09 g/mol. IUPAC: N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine.
Chemical Property Profile of N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine
Property Insights of N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine. Following Lipinski's Rule of Five, N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine has 2 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 N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine?
The CAS number of N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine is 200431-98-7.
What is the molecular formula of N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine?
The molecular formula of N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine is C8H9N5.
What is the molecular weight of N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine?
The molecular weight of N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine is 175.09 g/mol.
Where can I buy N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine?
You can request a quote for N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.