![6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one structure](/static/products/896/896833-01-5.png)
6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one
TL;DR: 6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one (CAS 896833-01-5) is a chemical compound with molecular formula C22H22N2O5 and molecular weight 394.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-6-hydroxy-7-[(2-methylpiperidin-1-yl)methyl]-2-[(4-nitrophenyl)methylidene]-1-benzofuran-3-one
Also Known As: 6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one, (2Z)-6-hydroxy-7-[(2-methylpiperidin-1-yl)methyl]-2-[(4-nitrophenyl)methylidene]-1-benzofuran-3-one, (Z)-6-hydroxy-7-((2-methylpiperidin-1-yl)methyl)-2-(4-nitrobenzylidene)benzofuran-3(2H)-one
| Molecular Formula | C22H22N2O5 |
|---|---|
| Molecular Weight | 394.15 g/mol |
| LogP | 4.291 |
| Topological Polar Surface Area | 92.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 394.15286 |
| Heavy Atoms | 29 |
| Complexity | 997.0074 |
Chemical Identifiers
| CAS Number | 896833-01-5 |
|---|---|
| SMILES | CC1CCCCN1CC2=C(C=CC3=C2O/C(=C\C4=CC=C(C=C4)[N+](=O)[O-])/C3=O)O |
Product Overview
6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one (CAS 896833-01-5), with molecular formula C22H22N2O5 and molecular weight 394.15 g/mol. IUPAC: (2Z)-6-hydroxy-7-[(2-methylpiperidin-1-yl)methyl]-2-[(4-nitrophenyl)methylidene]-1-benzofuran-3-one.
Chemical Property Profile of 6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one
Property Insights of 6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one
The XLogP value of 4.291 indicates that 6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one. Following Lipinski's Rule of Five, 6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one 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 6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one?
The CAS number of 6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one is 896833-01-5.
What is the molecular formula of 6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one?
The molecular formula of 6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one is C22H22N2O5.
What is the molecular weight of 6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one?
The molecular weight of 6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one is 394.15 g/mol.
Where can I buy 6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one?
You can request a quote for 6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one?
Yes, KEHONG BIO provides custom synthesis services for 6-hydroxy-7-[(2-methyl-1-piperidyl)methyl]-2-[(4-nitrophenyl)methylidene]benzofuran-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.