4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline
TL;DR: 4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline (CAS 129075-92-9) is a chemical compound with molecular formula C17H20N4 and molecular weight 280.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(benzotriazol-1-ylmethyl)-N,N-diethylaniline
Also Known As: 4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline, 4-(benzotriazol-1-ylmethyl)-N,N-diethyl-aniline, 4-(benzotriazol-1-ylmethyl)-N,N-diethylaniline, 4-[(1H-Benzotriazol-1-yl)methyl]-N,N-diethylaniline, 4-[(1H-1,2,3-benzotriazol-1-yl)methyl]-N,N-diethylaniline
| Molecular Formula | C17H20N4 |
|---|---|
| Molecular Weight | 280.17 g/mol |
| LogP | 3.3258 |
| Topological Polar Surface Area | 33.95 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 280.1688 |
| Heavy Atoms | 21 |
| Complexity | 710.9931 |
Chemical Identifiers
| CAS Number | 129075-92-9 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=N2 |
Product Overview
4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline (CAS 129075-92-9), with molecular formula C17H20N4 and molecular weight 280.17 g/mol. IUPAC: 4-(benzotriazol-1-ylmethyl)-N,N-diethylaniline.
Chemical Property Profile of 4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline
Property Insights of 4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline
The XLogP value of 3.3258 indicates that 4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.95 Ų, 4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline 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 4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline?
The CAS number of 4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline is 129075-92-9.
What is the molecular formula of 4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline?
The molecular formula of 4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline is C17H20N4.
What is the molecular weight of 4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline?
The molecular weight of 4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline is 280.17 g/mol.
Where can I buy 4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline?
You can request a quote for 4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N,N-diethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.