5-Phenethyl-1H-(1,2,4)triazol-3-ylamine
TL;DR: 5-Phenethyl-1H-(1,2,4)triazol-3-ylamine (CAS 180918-40-5) is a chemical compound with molecular formula C10H12N4 and molecular weight 188.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-phenylethyl)-1H-1,2,4-triazol-3-amine
Also Known As: 5-Phenethyl-1H-[1,2,4]triazol-3-ylamine, 5-phenethyl-1H-1,2,4-triazol-3-amine, 5-(2-phenylethyl)-1H-1,2,4-triazol-3-amine, 3-(2-PHENYLETHYL)-1H-1,2,4-TRIAZOL-5-AMINE, CHEMBRDG-BB4015724
| Molecular Formula | C10H12N4 |
|---|---|
| Molecular Weight | 188.11 g/mol |
| LogP | 1.1721 |
| Topological Polar Surface Area | 67.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 188.1062 |
| Heavy Atoms | 14 |
| Complexity | 393.51407 |
Chemical Identifiers
| CAS Number | 180918-40-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCC2=NC(=NN2)N |
Product Overview
5-Phenethyl-1H-(1,2,4)triazol-3-ylamine (CAS 180918-40-5), with molecular formula C10H12N4 and molecular weight 188.11 g/mol. IUPAC: 5-(2-phenylethyl)-1H-1,2,4-triazol-3-amine.
Chemical Property Profile of 5-Phenethyl-1H-(1,2,4)triazol-3-ylamine
Property Insights of 5-Phenethyl-1H-(1,2,4)triazol-3-ylamine
The XLogP value of 1.1721 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Phenethyl-1H-(1,2,4)triazol-3-ylamine. The TPSA of 67.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Phenethyl-1H-(1,2,4)triazol-3-ylamine. Following Lipinski's Rule of Five, 5-Phenethyl-1H-(1,2,4)triazol-3-ylamine has 2 hydrogen bond donor(s) and 3 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 5-Phenethyl-1H-(1,2,4)triazol-3-ylamine?
The CAS number of 5-Phenethyl-1H-(1,2,4)triazol-3-ylamine is 180918-40-5.
What is the molecular formula of 5-Phenethyl-1H-(1,2,4)triazol-3-ylamine?
The molecular formula of 5-Phenethyl-1H-(1,2,4)triazol-3-ylamine is C10H12N4.
What is the molecular weight of 5-Phenethyl-1H-(1,2,4)triazol-3-ylamine?
The molecular weight of 5-Phenethyl-1H-(1,2,4)triazol-3-ylamine is 188.11 g/mol.
Where can I buy 5-Phenethyl-1H-(1,2,4)triazol-3-ylamine?
You can request a quote for 5-Phenethyl-1H-(1,2,4)triazol-3-ylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Phenethyl-1H-(1,2,4)triazol-3-ylamine?
Yes, KEHONG BIO provides custom synthesis services for 5-Phenethyl-1H-(1,2,4)triazol-3-ylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.