6-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate
TL;DR: 6-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate (CAS 868680-05-1) is a chemical compound with molecular formula C15H12N2O5 and molecular weight 300.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-methyl-3-nitro-2-oxo-1H-pyridin-4-yl) (E)-3-phenylprop-2-enoate
Also Known As: 6-methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate, AB00676254-01, F1826-0084, (6-methyl-3-nitro-2-oxo-1H-pyridin-4-yl) (E)-3-phenylprop-2-enoate, 6-methyl-3-nitro-2-oxo-1,2-dihydro-4-pyridyl (E)-cinnamate
| Molecular Formula | C15H12N2O5 |
|---|---|
| Molecular Weight | 300.07 g/mol |
| LogP | 2.21032 |
| Topological Polar Surface Area | 102.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.07462 |
| Heavy Atoms | 22 |
| Complexity | 793.32526 |
Chemical Identifiers
| CAS Number | 868680-05-1 |
|---|---|
| SMILES | CC1=CC(=C(C(=O)N1)[N+](=O)[O-])OC(=O)/C=C/C2=CC=CC=C2 |
Product Overview
6-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate (CAS 868680-05-1), with molecular formula C15H12N2O5 and molecular weight 300.07 g/mol. IUPAC: (6-methyl-3-nitro-2-oxo-1H-pyridin-4-yl) (E)-3-phenylprop-2-enoate.
Chemical Property Profile of 6-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate
Property Insights of 6-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate
The XLogP value of 2.21032 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate. The TPSA of 102.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate. Following Lipinski's Rule of Five, 6-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate has 1 hydrogen bond donor(s) and 5 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-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate?
The CAS number of 6-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate is 868680-05-1.
What is the molecular formula of 6-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate?
The molecular formula of 6-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate is C15H12N2O5.
What is the molecular weight of 6-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate?
The molecular weight of 6-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate is 300.07 g/mol.
Where can I buy 6-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate?
You can request a quote for 6-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate?
Yes, KEHONG BIO provides custom synthesis services for 6-Methyl-3-nitro-2-oxo-1,2-dihydropyridin-4-yl cinnamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.