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N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline
TL;DR: N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline (CAS 327050-52-2) is a chemical compound with molecular formula C20H25N3O3 and molecular weight 355.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline
Also Known As: BAS 00547032, BIM-0025712.P001, (2-Nitro-5-piperidin-1-yl-phenyl)-(2-o-tolyloxy-ethyl)-amine, N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-(piperidin-1-yl)aniline, N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline
| Molecular Formula | C20H25N3O3 |
|---|---|
| Molecular Weight | 355.19 g/mol |
| LogP | 4.38442 |
| Topological Polar Surface Area | 67.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 355.1896 |
| Heavy Atoms | 26 |
| Complexity | 757.7167 |
Chemical Identifiers
| CAS Number | 327050-52-2 |
|---|---|
| SMILES | CC1=CC=CC=C1OCCNC2=C(C=CC(=C2)N3CCCCC3)[N+](=O)[O-] |
Product Overview
N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline (CAS 327050-52-2), with molecular formula C20H25N3O3 and molecular weight 355.19 g/mol. IUPAC: N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline.
Chemical Property Profile of N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline
Property Insights of N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline
The XLogP value of 4.38442 indicates that N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.64 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline. Following Lipinski's Rule of Five, N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline has 1 hydrogen bond donor(s) and 5 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-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline?
The CAS number of N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline is 327050-52-2.
What is the molecular formula of N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline?
The molecular formula of N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline is C20H25N3O3.
What is the molecular weight of N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline?
The molecular weight of N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline is 355.19 g/mol.
Where can I buy N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline?
You can request a quote for N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(2-methylphenoxy)ethyl]-2-nitro-5-piperidin-1-ylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.