Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate
TL;DR: Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate (CAS 16134-01-3) is a chemical compound with molecular formula C11H8N2O5 and molecular weight 248.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 8-nitro-4-oxo-1H-quinoline-2-carboxylate
Also Known As: methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate, methyl 8-nitro-4-oxo-1H-quinoline-2-carboxylate, ZERO/004664, Methyl 4-hydroxy-8-nitroquinoline-2-carboxylate, J1.959.342H
| Molecular Formula | C11H8N2O5 |
|---|---|
| Molecular Weight | 248.04 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.04332 |
| Heavy Atoms | 18 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 16134-01-3 |
|---|---|
| SMILES | COC(=O)C1=CC(=O)C2=C(N1)C(=CC=C2)[N+](=O)[O-] |
| InChIKey | NOGQBLIKIZVQKT-UHFFFAOYSA-N |
Product Overview
Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate (CAS 16134-01-3), with molecular formula C11H8N2O5 and molecular weight 248.04 g/mol. IUPAC: methyl 8-nitro-4-oxo-1H-quinoline-2-carboxylate.
Chemical Property Profile of Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate
Property Insights of Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate. Following Lipinski's Rule of Five, Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate has 1 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 Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate?
The CAS number of Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate is 16134-01-3.
What is the molecular formula of Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate?
The molecular formula of Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate is C11H8N2O5.
What is the molecular weight of Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate?
The molecular weight of Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate is 248.04 g/mol.
Where can I buy Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate?
You can request a quote for Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 8-nitro-4-oxo-1,4-dihydroquinoline-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.