{4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine
TL;DR: {4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine (CAS 708992-41-0) is a chemical compound with molecular formula C20H19N5 and molecular weight 329.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(naphthalen-1-ylmethylamino)phenyl]methyl]-1H-1,2,4-triazol-5-amine
Also Known As: TimTec1_008508, BAS 09090504, {4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine, N-[[4-(naphthalen-1-ylmethylamino)phenyl]methyl]-1H-1,2,4-triazol-5-amine, N-{4-[(1-naphthylmethyl)amino]benzyl}-1H-1,2,4-triazol-5-amine
| Molecular Formula | C20H19N5 |
|---|---|
| Molecular Weight | 329.16 g/mol |
| LogP | 4.1821 |
| Topological Polar Surface Area | 65.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 329.16403 |
| Heavy Atoms | 25 |
| Complexity | 940.17206 |
Chemical Identifiers
| CAS Number | 708992-41-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2CNC3=CC=C(C=C3)CNC4=NC=NN4 |
Product Overview
{4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine (CAS 708992-41-0), with molecular formula C20H19N5 and molecular weight 329.16 g/mol. IUPAC: N-[[4-(naphthalen-1-ylmethylamino)phenyl]methyl]-1H-1,2,4-triazol-5-amine.
Chemical Property Profile of {4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine
Property Insights of {4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine
The XLogP value of 4.1821 indicates that {4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.63 Ų falls within the moderate polarity range, balancing permeability and solubility for {4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine. Following Lipinski's Rule of Five, {4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine has 3 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 {4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine?
The CAS number of {4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine is 708992-41-0.
What is the molecular formula of {4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine?
The molecular formula of {4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine is C20H19N5.
What is the molecular weight of {4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine?
The molecular weight of {4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine is 329.16 g/mol.
Where can I buy {4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine?
You can request a quote for {4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine?
Yes, KEHONG BIO provides custom synthesis services for {4-[(Naphthalen-1-ylmethyl)-amino]-benzyl}-(2H-[1,2,4]triazol-3-yl)-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.