1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone
TL;DR: 1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone (CAS 774550-90-2) is a chemical compound with molecular formula C24H26N4O5 and molecular weight 450.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone
Also Known As: 1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone, Benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone, 1-benzofuran-2-yl(4-{4-nitro-3-[(tetrahydrofuran-2-ylmethyl)amino]phenyl}piperazin-1-yl)methanone
| Molecular Formula | C24H26N4O5 |
|---|---|
| Molecular Weight | 450.19 g/mol |
| LogP | 3.8943 |
| Topological Polar Surface Area | 101.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 450.1903 |
| Heavy Atoms | 33 |
| Complexity | 1129.6259 |
Chemical Identifiers
| CAS Number | 774550-90-2 |
|---|---|
| SMILES | C1CC(OC1)CNC2=C(C=CC(=C2)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5O4)[N+](=O)[O-] |
Product Overview
1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone (CAS 774550-90-2), with molecular formula C24H26N4O5 and molecular weight 450.19 g/mol. IUPAC: 1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone.
Chemical Property Profile of 1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone
Property Insights of 1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone
The XLogP value of 3.8943 indicates that 1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone. Following Lipinski's Rule of Five, 1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone has 1 hydrogen bond donor(s) and 7 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-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone?
The CAS number of 1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone is 774550-90-2.
What is the molecular formula of 1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone?
The molecular formula of 1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone is C24H26N4O5.
What is the molecular weight of 1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone?
The molecular weight of 1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone is 450.19 g/mol.
Where can I buy 1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone?
You can request a quote for 1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]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-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone?
Yes, KEHONG BIO provides custom synthesis services for 1-benzofuran-2-yl-[4-[4-nitro-3-(oxolan-2-ylmethylamino)phenyl]piperazin-1-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.