![[4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone structure](/static/products/7745/774564-02-2.webp)
[4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone
TL;DR: [4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone (CAS 774564-02-2) is a chemical compound with molecular formula C20H26N4O3S and molecular weight 402.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone
Also Known As: [4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone, (4-{3-[(2,2-dimethylpropyl)amino]-4-nitrophenyl}piperazin-1-yl)(thiophen-2-yl)methanone
| Molecular Formula | C20H26N4O3S |
|---|---|
| Molecular Weight | 402.17 g/mol |
| LogP | 4.0767 |
| Topological Polar Surface Area | 78.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 402.17258 |
| Heavy Atoms | 28 |
| Complexity | 837.63086 |
Chemical Identifiers
| CAS Number | 774564-02-2 |
|---|---|
| SMILES | CC(C)(C)CNC1=C(C=CC(=C1)N2CCN(CC2)C(=O)C3=CC=CS3)[N+](=O)[O-] |
Product Overview
[4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone (CAS 774564-02-2), with molecular formula C20H26N4O3S and molecular weight 402.17 g/mol. IUPAC: [4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone.
Chemical Property Profile of [4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone
Property Insights of [4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone
The XLogP value of 4.0767 indicates that [4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone 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-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone. Following Lipinski's Rule of Five, [4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone 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 [4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone?
The CAS number of [4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone is 774564-02-2.
What is the molecular formula of [4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone?
The molecular formula of [4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone is C20H26N4O3S.
What is the molecular weight of [4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone?
The molecular weight of [4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone is 402.17 g/mol.
Where can I buy [4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone?
You can request a quote for [4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone?
Yes, KEHONG BIO provides custom synthesis services for [4-[3-(2,2-dimethylpropylamino)-4-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.