N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine
TL;DR: N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine (CAS 100521-68-4) is a chemical compound with molecular formula C13H21BrN2 and molecular weight 284.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-bromophenyl)methyl]-N',N'-diethylethane-1,2-diamine
Also Known As: N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine, N'-[(4-bromophenyl)methyl]-N,N-diethyl-ethane-1,2-diamine, N-[(4-bromophenyl)methyl]-N',N'-diethylethane-1,2-diamine, 1,2-Ethanediamine, N2-[(4-bromophenyl)methyl]-N1,N1-diethyl-
| Molecular Formula | C13H21BrN2 |
|---|---|
| Molecular Weight | 284.09 g/mol |
| LogP | 2.8805 |
| Topological Polar Surface Area | 15.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 284.0888 |
| Heavy Atoms | 16 |
| Complexity | 280.48898 |
Chemical Identifiers
| CAS Number | 100521-68-4 |
|---|---|
| SMILES | CCN(CC)CCNCC1=CC=C(C=C1)Br |
Product Overview
N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine (CAS 100521-68-4), with molecular formula C13H21BrN2 and molecular weight 284.09 g/mol. IUPAC: N-[(4-bromophenyl)methyl]-N',N'-diethylethane-1,2-diamine.
Chemical Property Profile of N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine
Property Insights of N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine
The XLogP value of 2.8805 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine. With a topological polar surface area (TPSA) of 15.27 Ų, N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine has 1 hydrogen bond donor(s) and 2 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'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine?
The CAS number of N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine is 100521-68-4.
What is the molecular formula of N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine?
The molecular formula of N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine is C13H21BrN2.
What is the molecular weight of N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine?
The molecular weight of N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine is 284.09 g/mol.
Where can I buy N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine?
You can request a quote for N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine?
Yes, KEHONG BIO provides custom synthesis services for N'-(4-Bromo-benzyl)-N,N-diethyl-ethane-1,2-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.