2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine
TL;DR: 2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine (CAS 416887-93-9) is a chemical compound with molecular formula C15H15ClN2O2 and molecular weight 290.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-N-[(4-nitrophenyl)methyl]ethanamine
Also Known As: 2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine, CHEMBRDG-BB5521550, CHEMBRDG-BB 5521550, BIM-0025769.P001, W-7955
| Molecular Formula | C15H15ClN2O2 |
|---|---|
| Molecular Weight | 290.08 g/mol |
| LogP | 3.5805 |
| Topological Polar Surface Area | 55.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 290.0822 |
| Heavy Atoms | 20 |
| Complexity | 567.4323 |
Chemical Identifiers
| CAS Number | 416887-93-9 |
|---|---|
| SMILES | C1=CC(=CC=C1CCNCC2=CC=C(C=C2)[N+](=O)[O-])Cl |
Product Overview
2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine (CAS 416887-93-9), with molecular formula C15H15ClN2O2 and molecular weight 290.08 g/mol. IUPAC: 2-(4-chlorophenyl)-N-[(4-nitrophenyl)methyl]ethanamine.
Chemical Property Profile of 2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine
Property Insights of 2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine
The XLogP value of 3.5805 indicates that 2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.17 Ų, 2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine has 1 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 2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine?
The CAS number of 2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine is 416887-93-9.
What is the molecular formula of 2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine?
The molecular formula of 2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine is C15H15ClN2O2.
What is the molecular weight of 2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine?
The molecular weight of 2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine is 290.08 g/mol.
Where can I buy 2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine?
You can request a quote for 2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-chlorophenyl)-N-(4-nitrobenzyl)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.