![1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone structure](/static/products/7142/714209-94-6.webp)
1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone
TL;DR: 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone (CAS 714209-94-6) is a chemical compound with molecular formula C28H26N4O4 and molecular weight 482.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone
Also Known As: 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone, 1-benzofuran-2-yl{4-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-4-nitrophenyl]piperazin-1-yl}methanone, Benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitro-phenyl]piperazin-1-yl]methanone
| Molecular Formula | C28H26N4O4 |
|---|---|
| Molecular Weight | 482.20 g/mol |
| LogP | 4.8661 |
| Topological Polar Surface Area | 83.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 482.1954 |
| Heavy Atoms | 36 |
| Complexity | 1421.9742 |
Chemical Identifiers
| CAS Number | 714209-94-6 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)C3=C(C=CC(=C3)N4CCN(CC4)C(=O)C5=CC6=CC=CC=C6O5)[N+](=O)[O-] |
Product Overview
1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone (CAS 714209-94-6), with molecular formula C28H26N4O4 and molecular weight 482.20 g/mol. IUPAC: 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone.
Chemical Property Profile of 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone
Property Insights of 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone
The XLogP value of 4.8661 indicates that 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone. Following Lipinski's Rule of Five, 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone has 0 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 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone?
The CAS number of 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone is 714209-94-6.
What is the molecular formula of 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone?
The molecular formula of 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone is C28H26N4O4.
What is the molecular weight of 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone?
The molecular weight of 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone is 482.20 g/mol.
Where can I buy 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone?
You can request a quote for 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone?
Yes, KEHONG BIO provides custom synthesis services for 1-benzofuran-2-yl-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-4-nitrophenyl]piperazin-1-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.