![Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate structure](/static/products/304/304875-77-2.png)
Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate
TL;DR: Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate (CAS 304875-77-2) is a chemical compound with molecular formula C20H17N3O6 and molecular weight 395.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate
Also Known As: methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate
| Molecular Formula | C20H17N3O6 |
|---|---|
| Molecular Weight | 395.11 g/mol |
| LogP | 2.0971 |
| Topological Polar Surface Area | 118.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.11172 |
| Heavy Atoms | 29 |
| Complexity | 985.03595 |
Chemical Identifiers
| CAS Number | 304875-77-2 |
|---|---|
| SMILES | COC(=O)CC1C(=O)C=C(N(N1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3 |
Product Overview
Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate (CAS 304875-77-2), with molecular formula C20H17N3O6 and molecular weight 395.11 g/mol. IUPAC: methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate.
Chemical Property Profile of Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate
Property Insights of Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate
The XLogP value of 2.0971 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate. The TPSA of 118.85 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate. Following Lipinski's Rule of Five, Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate 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 Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate?
The CAS number of Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate is 304875-77-2.
What is the molecular formula of Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate?
The molecular formula of Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate is C20H17N3O6.
What is the molecular weight of Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate?
The molecular weight of Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate is 395.11 g/mol.
Where can I buy Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate?
You can request a quote for Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.