1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone
TL;DR: 1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone (CAS 150784-49-9) is a chemical compound with molecular formula C13H17N3O3 and molecular weight 263.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone
Also Known As: 1-(4-methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone, 1-methyl-4-[(4-nitrophenyl)acetyl]piperazine, 1-(4-methylpiperazinyl)-2-(4-nitrophenyl)ethan-1-one, 1-(4-METHYLPIPERAZINO)-2-(4-NITROPHENYL)-1-ETHANONE
| Molecular Formula | C13H17N3O3 |
|---|---|
| Molecular Weight | 263.13 g/mol |
| LogP | 0.9113 |
| Topological Polar Surface Area | 66.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 263.12698 |
| Heavy Atoms | 19 |
| Complexity | 464.5267 |
Chemical Identifiers
| CAS Number | 150784-49-9 |
|---|---|
| SMILES | CN1CCN(CC1)C(=O)CC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone (CAS 150784-49-9), with molecular formula C13H17N3O3 and molecular weight 263.13 g/mol. IUPAC: 1-(4-methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone.
Chemical Property Profile of 1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone
Property Insights of 1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone
The XLogP value of 0.9113 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone. The TPSA of 66.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone. Following Lipinski's Rule of Five, 1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone has 0 hydrogen bond donor(s) and 4 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 1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone?
The CAS number of 1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone is 150784-49-9.
What is the molecular formula of 1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone?
The molecular formula of 1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone is C13H17N3O3.
What is the molecular weight of 1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone?
The molecular weight of 1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone is 263.13 g/mol.
Where can I buy 1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone?
You can request a quote for 1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.