N-(2-chloroethyl)-1,2,4-triazin-3-amine
TL;DR: N-(2-chloroethyl)-1,2,4-triazin-3-amine (CAS 61108-77-8) is a chemical compound with molecular formula C5H7ClN4 and molecular weight 158.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloroethyl)-1,2,4-triazin-3-amine
Also Known As: N-(2-chloroethyl)-1,2,4-triazin-3-amine, (2-chloro-ethyl)-[1,2,4]triazin-3-yl-amine
| Molecular Formula | C5H7ClN4 |
|---|---|
| Molecular Weight | 158.04 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 50.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 158.03592 |
| Heavy Atoms | 10 |
| Complexity | 89.0 |
Chemical Identifiers
| CAS Number | 61108-77-8 |
|---|---|
| SMILES | C1=CN=NC(=N1)NCCCl |
| InChIKey | GVEOKMYHVMWAFM-UHFFFAOYSA-N |
Product Overview
N-(2-chloroethyl)-1,2,4-triazin-3-amine (CAS 61108-77-8), with molecular formula C5H7ClN4 and molecular weight 158.04 g/mol. IUPAC: N-(2-chloroethyl)-1,2,4-triazin-3-amine.
Chemical Property Profile of N-(2-chloroethyl)-1,2,4-triazin-3-amine
Property Insights of N-(2-chloroethyl)-1,2,4-triazin-3-amine
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-chloroethyl)-1,2,4-triazin-3-amine. With a topological polar surface area (TPSA) of 50.7 Ų, N-(2-chloroethyl)-1,2,4-triazin-3-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-chloroethyl)-1,2,4-triazin-3-amine has 1 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-(2-chloroethyl)-1,2,4-triazin-3-amine?
The CAS number of N-(2-chloroethyl)-1,2,4-triazin-3-amine is 61108-77-8.
What is the molecular formula of N-(2-chloroethyl)-1,2,4-triazin-3-amine?
The molecular formula of N-(2-chloroethyl)-1,2,4-triazin-3-amine is C5H7ClN4.
What is the molecular weight of N-(2-chloroethyl)-1,2,4-triazin-3-amine?
The molecular weight of N-(2-chloroethyl)-1,2,4-triazin-3-amine is 158.04 g/mol.
Where can I buy N-(2-chloroethyl)-1,2,4-triazin-3-amine?
You can request a quote for N-(2-chloroethyl)-1,2,4-triazin-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-chloroethyl)-1,2,4-triazin-3-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-chloroethyl)-1,2,4-triazin-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.