5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline
TL;DR: 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline (CAS 432495-79-9) is a chemical compound with molecular formula C20H24N4O2 and molecular weight 352.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline
Also Known As: 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline, AB00119486-01, A3044/0128528, cyclopropyl{2-nitro-5-[4-benzylpiperazinyl]phenyl}amine, N-[5-(4-BENZYLPIPERAZINO)-2-NITROPHENYL]-N-CYCLOPROPYLAMINE
| Molecular Formula | C20H24N4O2 |
|---|---|
| Molecular Weight | 352.19 g/mol |
| LogP | 3.4913 |
| Topological Polar Surface Area | 61.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 352.1899 |
| Heavy Atoms | 26 |
| Complexity | 768.63556 |
Chemical Identifiers
| CAS Number | 432495-79-9 |
|---|---|
| SMILES | C1CC1NC2=C(C=CC(=C2)N3CCN(CC3)CC4=CC=CC=C4)[N+](=O)[O-] |
Product Overview
5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline (CAS 432495-79-9), with molecular formula C20H24N4O2 and molecular weight 352.19 g/mol. IUPAC: 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline.
Chemical Property Profile of 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline
Property Insights of 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline
The XLogP value of 3.4913 indicates that 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline. Following Lipinski's Rule of Five, 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline 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 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline?
The CAS number of 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline is 432495-79-9.
What is the molecular formula of 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline?
The molecular formula of 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline is C20H24N4O2.
What is the molecular weight of 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline?
The molecular weight of 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline is 352.19 g/mol.
Where can I buy 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline?
You can request a quote for 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-benzylpiperazin-1-yl)-N-cyclopropyl-2-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.