2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester
TL;DR: 2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester (CAS 55540-58-4) is a chemical compound with molecular formula C17H11N3O7 and molecular weight 369.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7-nitroquinolin-8-yl) (E)-2-methyl-3-(5-nitrofuran-2-yl)prop-2-enoate
Also Known As: 2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester, 2-Methyl-3-(5-nitro-2-furanyl)-2-propenoic acid 7-nitro-8-quinolinyl ester, (7-nitroquinolin-8-yl) (E)-2-methyl-3-(5-nitrofuran-2-yl)prop-2-enoate, RefChem:1064515, BRN 1515147
| Molecular Formula | C17H11N3O7 |
|---|---|
| Molecular Weight | 369.06 g/mol |
| LogP | 3.6531 |
| Topological Polar Surface Area | 138.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 369.0597 |
| Heavy Atoms | 27 |
| Complexity | 1100.855 |
Chemical Identifiers
| CAS Number | 55540-58-4 |
|---|---|
| SMILES | C/C(=C\C1=CC=C(O1)[N+](=O)[O-])/C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-] |
Product Overview
2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester (CAS 55540-58-4), with molecular formula C17H11N3O7 and molecular weight 369.06 g/mol. IUPAC: (7-nitroquinolin-8-yl) (E)-2-methyl-3-(5-nitrofuran-2-yl)prop-2-enoate.
Chemical Property Profile of 2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester
Property Insights of 2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester
The XLogP value of 3.6531 indicates that 2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester. Following Lipinski's Rule of Five, 2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester has 0 hydrogen bond donor(s) and 8 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-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester?
The CAS number of 2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester is 55540-58-4.
What is the molecular formula of 2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester?
The molecular formula of 2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester is C17H11N3O7.
What is the molecular weight of 2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester?
The molecular weight of 2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester is 369.06 g/mol.
Where can I buy 2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester?
You can request a quote for 2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid, 2-methyl-3-(5-nitro-2-furanyl)-, 7-nitro-8-quinolinyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.