![[4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone structure](/static/products/7745/774549-80-3.webp)
[4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone
TL;DR: [4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone (CAS 774549-80-3) is a chemical compound with molecular formula C21H26N4O3 and molecular weight 382.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[3-(2-methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone
Also Known As: [4-[3-(2-methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone, (4-{3-[(2-methylpropyl)amino]-4-nitrophenyl}piperazin-1-yl)(phenyl)methanone
| Molecular Formula | C21H26N4O3 |
|---|---|
| Molecular Weight | 382.20 g/mol |
| LogP | 3.6251 |
| Topological Polar Surface Area | 78.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.2005 |
| Heavy Atoms | 28 |
| Complexity | 830.79926 |
Chemical Identifiers
| CAS Number | 774549-80-3 |
|---|---|
| SMILES | CC(C)CNC1=C(C=CC(=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)[N+](=O)[O-] |
Product Overview
[4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone (CAS 774549-80-3), with molecular formula C21H26N4O3 and molecular weight 382.20 g/mol. IUPAC: [4-[3-(2-methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone.
Chemical Property Profile of [4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone
Property Insights of [4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone
The XLogP value of 3.6251 indicates that [4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.72 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone. Following Lipinski's Rule of Five, [4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone 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 [4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone?
The CAS number of [4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone is 774549-80-3.
What is the molecular formula of [4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone?
The molecular formula of [4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone is C21H26N4O3.
What is the molecular weight of [4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone?
The molecular weight of [4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone is 382.20 g/mol.
Where can I buy [4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone?
You can request a quote for [4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone?
Yes, KEHONG BIO provides custom synthesis services for [4-[3-(2-Methylpropylamino)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.