N-Benzyl-N-ethyl-benzene-1,4-diamine
TL;DR: N-Benzyl-N-ethyl-benzene-1,4-diamine (CAS 58979-09-2) is a chemical compound with molecular formula C15H18N2 and molecular weight 226.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-benzyl-4-N-ethylbenzene-1,4-diamine
Also Known As: N-Benzyl-N-ethyl-benzene-1,4-diamine, N1-Benzyl-N1-ethylbenzene-1,4-diamine, 1-n-benzyl-1-n-ethylbenzene-1,4-diamine, 4-N-benzyl-4-N-ethylbenzene-1,4-diamine, N-Aethyl-N-benzyl-p-phenylendiamin
| Molecular Formula | C15H18N2 |
|---|---|
| Molecular Weight | 226.15 g/mol |
| LogP | 3.2953 |
| Topological Polar Surface Area | 29.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 226.147 |
| Heavy Atoms | 17 |
| Complexity | 448.10785 |
Chemical Identifiers
| CAS Number | 58979-09-2 |
|---|---|
| SMILES | CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)N |
Product Overview
N-Benzyl-N-ethyl-benzene-1,4-diamine (CAS 58979-09-2), with molecular formula C15H18N2 and molecular weight 226.15 g/mol. IUPAC: 4-N-benzyl-4-N-ethylbenzene-1,4-diamine.
Chemical Property Profile of N-Benzyl-N-ethyl-benzene-1,4-diamine
Property Insights of N-Benzyl-N-ethyl-benzene-1,4-diamine
The XLogP value of 3.2953 indicates that N-Benzyl-N-ethyl-benzene-1,4-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.26 Ų, N-Benzyl-N-ethyl-benzene-1,4-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Benzyl-N-ethyl-benzene-1,4-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-Benzyl-N-ethyl-benzene-1,4-diamine?
The CAS number of N-Benzyl-N-ethyl-benzene-1,4-diamine is 58979-09-2.
What is the molecular formula of N-Benzyl-N-ethyl-benzene-1,4-diamine?
The molecular formula of N-Benzyl-N-ethyl-benzene-1,4-diamine is C15H18N2.
What is the molecular weight of N-Benzyl-N-ethyl-benzene-1,4-diamine?
The molecular weight of N-Benzyl-N-ethyl-benzene-1,4-diamine is 226.15 g/mol.
Where can I buy N-Benzyl-N-ethyl-benzene-1,4-diamine?
You can request a quote for N-Benzyl-N-ethyl-benzene-1,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Benzyl-N-ethyl-benzene-1,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for N-Benzyl-N-ethyl-benzene-1,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.