2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate
TL;DR: 2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate (CAS 326883-01-6) is a chemical compound with molecular formula C23H17NO6 and molecular weight 403.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methoxy-4-(3-oxo-3-phenylprop-1-enyl)phenyl] 3-nitrobenzoate
Also Known As: [2-methoxy-4-(3-oxo-3-phenylprop-1-enyl)phenyl] 3-nitrobenzoate|2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate|3-[3-Methoxy-4-[(3-nitrobenzoyl)oxy]phenyl]-1-phenyl-2-propen-1-one
| Molecular Formula | C23H17NO6 |
|---|---|
| Molecular Weight | 403.11 g/mol |
| LogP | 4.7187 |
| Topological Polar Surface Area | 95.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 403.1056 |
| Heavy Atoms | 30 |
| Complexity | 1121.5471 |
Chemical Identifiers
| CAS Number | 326883-01-6 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C=CC(=O)C2=CC=CC=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate (CAS 326883-01-6), with molecular formula C23H17NO6 and molecular weight 403.11 g/mol. IUPAC: [2-methoxy-4-(3-oxo-3-phenylprop-1-enyl)phenyl] 3-nitrobenzoate.
Chemical Property Profile of 2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate
Property Insights of 2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate
The XLogP value of 4.7187 indicates that 2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate. Following Lipinski's Rule of Five, 2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate 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 2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate?
The CAS number of 2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate is 326883-01-6.
What is the molecular formula of 2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate?
The molecular formula of 2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate is C23H17NO6.
What is the molecular weight of 2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate?
The molecular weight of 2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate is 403.11 g/mol.
Where can I buy 2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate?
You can request a quote for 2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxy-4-(3-oxo-3-phenylprop-1-en-1-yl)phenyl 3-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.