N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine
TL;DR: N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine (CAS 869946-50-9) is a chemical compound with molecular formula C13H12N4 and molecular weight 224.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-5-amine
Also Known As: ASN 07018918, N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine, N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-5-amine, 1H-1,2,4-triazol-3-yl(naphthylmethyl)amine, AN-465/14526017
| Molecular Formula | C13H12N4 |
|---|---|
| Molecular Weight | 224.11 g/mol |
| LogP | 2.57 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 224.1062 |
| Heavy Atoms | 17 |
| Complexity | 610.9106 |
Chemical Identifiers
| CAS Number | 869946-50-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2CNC3=NC=NN3 |
Product Overview
N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine (CAS 869946-50-9), with molecular formula C13H12N4 and molecular weight 224.11 g/mol. IUPAC: N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-5-amine.
Chemical Property Profile of N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine
Property Insights of N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine
The XLogP value of 2.57 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine. With a topological polar surface area (TPSA) of 53.6 Ų, N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine 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 N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine?
The CAS number of N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine is 869946-50-9.
What is the molecular formula of N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine?
The molecular formula of N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine is C13H12N4.
What is the molecular weight of N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine?
The molecular weight of N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine is 224.11 g/mol.
Where can I buy N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine?
You can request a quote for N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-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-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(naphthalen-1-ylmethyl)-1H-1,2,4-triazol-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.