Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester
TL;DR: Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester (CAS 29002-34-4) is a chemical compound with molecular formula C19H13N3O6 and molecular weight 379.08 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-(2-nitrophenyl)prop-2-enoate
Also Known As: 2- propanoicacid7-nitro-8-quinolylester, alpha-Methyl-o-nitrocinnamic acid 7-nitro-8-quinolyl ester, CINNAMIC ACID, alpha-METHYL-o-NITRO-, 7-NITRO-8-QUINOLYL ESTER, 2-Propenoic acid, 2-methyl-3-(2-nitrophenyl)-, 7-nitro-8-quinolinyl ester, 2-(2-Nitrobenzylidene)propanoic acid 7-nitro-8-quinolyl ester
| Molecular Formula | C19H13N3O6 |
|---|---|
| Molecular Weight | 379.08 g/mol |
| LogP | 4.0601 |
| Topological Polar Surface Area | 125.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 379.08044 |
| Heavy Atoms | 28 |
| Complexity | 1139.472 |
Chemical Identifiers
| CAS Number | 29002-34-4 |
|---|---|
| SMILES | C/C(=C\C1=CC=CC=C1[N+](=O)[O-])/C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-] |
Product Overview
Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester (CAS 29002-34-4), with molecular formula C19H13N3O6 and molecular weight 379.08 g/mol. IUPAC: (7-nitroquinolin-8-yl) (E)-2-methyl-3-(2-nitrophenyl)prop-2-enoate.
Chemical Property Profile of Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester
Property Insights of Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester
The XLogP value of 4.0601 indicates that Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester. Following Lipinski's Rule of Five, Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester has 0 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 Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester?
The CAS number of Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester is 29002-34-4.
What is the molecular formula of Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester?
The molecular formula of Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester is C19H13N3O6.
What is the molecular weight of Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester?
The molecular weight of Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester is 379.08 g/mol.
Where can I buy Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester?
You can request a quote for Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester?
Yes, KEHONG BIO provides custom synthesis services for Cinnamic acid, alpha-methyl-o-nitro-, 7-nitro-8-quinolyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.