间乙氧基苯甲酸7-硝基-8-喹啉酯
TL;DR: 间乙氧基苯甲酸7-硝基-8-喹啉酯 (CAS 29002-09-3) is a chemical compound with molecular formula C18H14N2O5 and molecular weight 338.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
间乙氧基苯甲酸7-硝基-8-喹啉酯
(7-nitroquinolin-8-yl) 3-ethoxybenzoate
Also Known As: BENZOIC ACID, m-ETHOXY-, 7-NITRO-8-QUINOLYL ESTER, 7-Nitro-8-quinolinyl=m-ethoxybenzoate, 8-Quinolinol, 7-nitro-, m-ethoxybenzoate, (7-nitroquinolin-8-yl) 3-ethoxybenzoate, m-Ethoxybenzoic acid 7-nitro-8-quinolyl ester
| Molecular Formula | C18H14N2O5 |
|---|---|
| Molecular Weight | 338.09 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 94.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 338.09027 |
| Heavy Atoms | 25 |
| Complexity | 481.0 |
Chemical Identifiers
| CAS Number | 29002-09-3 |
|---|---|
| SMILES | CCOC1=CC=CC(=C1)C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-] |
| InChIKey | GSPLWVCWRITULV-UHFFFAOYSA-N |
Product Overview
间乙氧基苯甲酸7-硝基-8-喹啉酯 (CAS 29002-09-3), with molecular formula C18H14N2O5 and molecular weight 338.09 g/mol. IUPAC: (7-nitroquinolin-8-yl) 3-ethoxybenzoate.
Chemical Property Profile of 间乙氧基苯甲酸7-硝基-8-喹啉酯
Property Insights of 间乙氧基苯甲酸7-硝基-8-喹啉酯
The XLogP value of 3.8 indicates that 间乙氧基苯甲酸7-硝基-8-喹啉酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 间乙氧基苯甲酸7-硝基-8-喹啉酯. Following Lipinski's Rule of Five, 间乙氧基苯甲酸7-硝基-8-喹啉酯 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 间乙氧基苯甲酸7-硝基-8-喹啉酯?
The CAS number of 间乙氧基苯甲酸7-硝基-8-喹啉酯 is 29002-09-3.
What is the molecular formula of 间乙氧基苯甲酸7-硝基-8-喹啉酯?
The molecular formula of 间乙氧基苯甲酸7-硝基-8-喹啉酯 is C18H14N2O5.
What is the molecular weight of 间乙氧基苯甲酸7-硝基-8-喹啉酯?
The molecular weight of 间乙氧基苯甲酸7-硝基-8-喹啉酯 is 338.09 g/mol.
Where can I buy 间乙氧基苯甲酸7-硝基-8-喹啉酯?
You can request a quote for 间乙氧基苯甲酸7-硝基-8-喹啉酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 间乙氧基苯甲酸7-硝基-8-喹啉酯?
Yes, KEHONG BIO provides custom synthesis services for 间乙氧基苯甲酸7-硝基-8-喹啉酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.