4-Nitrophenyl quinoline-2-carboxylate
TL;DR: 4-Nitrophenyl quinoline-2-carboxylate (CAS 103131-56-2) is a chemical compound with molecular formula C16H10N2O4 and molecular weight 294.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) quinoline-2-carboxylate
Also Known As: 4-nitrophenyl quinoline-2-carboxylate, p-nitrophenyl quinaldate, (4-nitrophenyl) quinoline-2-carboxylate, 4-nitrophenyl 2-quinolinecarboxylate, p-nitrophenyl quinoline-2-carboxylate
| Molecular Formula | C16H10N2O4 |
|---|---|
| Molecular Weight | 294.06 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 85.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 294.06406 |
| Heavy Atoms | 22 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 103131-56-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC(=N2)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | ASTICKBBDNPFLV-UHFFFAOYSA-N |
Product Overview
4-Nitrophenyl quinoline-2-carboxylate (CAS 103131-56-2), with molecular formula C16H10N2O4 and molecular weight 294.06 g/mol. IUPAC: (4-nitrophenyl) quinoline-2-carboxylate.
Chemical Property Profile of 4-Nitrophenyl quinoline-2-carboxylate
Property Insights of 4-Nitrophenyl quinoline-2-carboxylate
The XLogP value of 3.8 indicates that 4-Nitrophenyl quinoline-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitrophenyl quinoline-2-carboxylate. Following Lipinski's Rule of Five, 4-Nitrophenyl quinoline-2-carboxylate has 0 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 4-Nitrophenyl quinoline-2-carboxylate?
The CAS number of 4-Nitrophenyl quinoline-2-carboxylate is 103131-56-2.
What is the molecular formula of 4-Nitrophenyl quinoline-2-carboxylate?
The molecular formula of 4-Nitrophenyl quinoline-2-carboxylate is C16H10N2O4.
What is the molecular weight of 4-Nitrophenyl quinoline-2-carboxylate?
The molecular weight of 4-Nitrophenyl quinoline-2-carboxylate is 294.06 g/mol.
Where can I buy 4-Nitrophenyl quinoline-2-carboxylate?
You can request a quote for 4-Nitrophenyl quinoline-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitrophenyl quinoline-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitrophenyl quinoline-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.