1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)-
TL;DR: 1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)- (CAS 51444-28-1) is a chemical compound with molecular formula C8H16N4 and molecular weight 168.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-2-(1,2,4-triazol-1-yl)ethanamine
Also Known As: 1-(2-Diethylaminoethyl)-1H-1,2,4-triazole, 1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)-, 5-26-01-00199 (Beilstein Handbook Reference), N,N-Diethyl-1H-1,2,4-triazole-1-ethanamine, N,N-diethyl-2-(1,2,4-triazol-1-yl)ethanamine
| Molecular Formula | C8H16N4 |
|---|---|
| Molecular Weight | 168.14 g/mol |
| LogP | 0.6199 |
| Topological Polar Surface Area | 33.95 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 168.1375 |
| Heavy Atoms | 12 |
| Complexity | 190.8326 |
Chemical Identifiers
| CAS Number | 51444-28-1 |
|---|---|
| SMILES | CCN(CC)CCN1C=NC=N1 |
Product Overview
1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)- (CAS 51444-28-1), with molecular formula C8H16N4 and molecular weight 168.14 g/mol. IUPAC: N,N-diethyl-2-(1,2,4-triazol-1-yl)ethanamine.
Chemical Property Profile of 1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)-
Property Insights of 1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)-
The XLogP value of 0.6199 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)-. With a topological polar surface area (TPSA) of 33.95 Ų, 1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)- has 0 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 1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)-?
The CAS number of 1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)- is 51444-28-1.
What is the molecular formula of 1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)-?
The molecular formula of 1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)- is C8H16N4.
What is the molecular weight of 1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)-?
The molecular weight of 1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)- is 168.14 g/mol.
Where can I buy 1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)-?
You can request a quote for 1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-1,2,4-Triazole, 1-(2-diethylaminoethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.