5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline
TL;DR: 5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline (CAS 354988-74-2) is a chemical compound with molecular formula C19H24N4O3 and molecular weight 356.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline
Also Known As: BAS 00434803, 5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline, [5-(4-methylpiperazinyl)-2-nitrophenyl](2-phenoxyethyl)amine, 5-(4-Methyl-1-piperazinyl)-2-nitro-N-(2-phenoxyethyl)benzenamine, [5-(4-Methyl-piperazin-1-yl)-2-nitro-phenyl]-(2-phenoxy-ethyl)-amine
| Molecular Formula | C19H24N4O3 |
|---|---|
| Molecular Weight | 356.18 g/mol |
| LogP | 2.8375 |
| Topological Polar Surface Area | 70.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 356.18484 |
| Heavy Atoms | 26 |
| Complexity | 730.81903 |
Chemical Identifiers
| CAS Number | 354988-74-2 |
|---|---|
| SMILES | CN1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NCCOC3=CC=CC=C3 |
Product Overview
5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline (CAS 354988-74-2), with molecular formula C19H24N4O3 and molecular weight 356.18 g/mol. IUPAC: 5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline.
Chemical Property Profile of 5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline
Property Insights of 5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline
The XLogP value of 2.8375 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline. The TPSA of 70.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline. Following Lipinski's Rule of Five, 5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline has 1 hydrogen bond donor(s) and 6 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-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline?
The CAS number of 5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline is 354988-74-2.
What is the molecular formula of 5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline?
The molecular formula of 5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline is C19H24N4O3.
What is the molecular weight of 5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline?
The molecular weight of 5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline is 356.18 g/mol.
Where can I buy 5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline?
You can request a quote for 5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-methylpiperazin-1-yl)-2-nitro-N-(2-phenoxyethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.