![N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine structure](/static/products/878/878714-00-2.png)
N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine
TL;DR: N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine (CAS 878714-00-2) is a chemical compound with molecular formula C13H18N4O2 and molecular weight 262.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine
Also Known As: ASN 12415923, N-(3,4-diethoxybenzyl)-1H-1,2,4-triazol-5-amine, N-(3,4-diethoxybenzyl)-N-(1H-1,2,4-triazol-3-yl)amine, N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine, N-(3,4-diethoxybenzyl)-1H-1,2,4-triazol-3-amine
| Molecular Formula | C13H18N4O2 |
|---|---|
| Molecular Weight | 262.14 g/mol |
| LogP | 2.2142 |
| Topological Polar Surface Area | 72.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 262.14297 |
| Heavy Atoms | 19 |
| Complexity | 499.34924 |
Chemical Identifiers
| CAS Number | 878714-00-2 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)CNC2=NC=NN2)OCC |
Product Overview
N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine (CAS 878714-00-2), with molecular formula C13H18N4O2 and molecular weight 262.14 g/mol. IUPAC: N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine.
Chemical Property Profile of N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine
Property Insights of N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine
The XLogP value of 2.2142 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine. The TPSA of 72.06 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine. Following Lipinski's Rule of Five, N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine has 2 hydrogen bond donor(s) and 5 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-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine?
The CAS number of N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine is 878714-00-2.
What is the molecular formula of N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine?
The molecular formula of N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine is C13H18N4O2.
What is the molecular weight of N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine?
The molecular weight of N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine is 262.14 g/mol.
Where can I buy N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine?
You can request a quote for N-[(3,4-diethoxyphenyl)methyl]-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-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.