1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone
TL;DR: 1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone (CAS 438593-06-7) is a chemical compound with molecular formula C17H12N2O3S and molecular weight 324.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-nitrophenyl)-2-quinolin-8-ylsulfanylethanone
Also Known As: AMS_CNC_ID-61971014, 1-(4-nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone, 1-(4-nitrophenyl)-2-quinolin-8-ylsulfanylethanone
| Molecular Formula | C17H12N2O3S |
|---|---|
| Molecular Weight | 324.06 g/mol |
| LogP | 4.118 |
| Topological Polar Surface Area | 73.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 324.05685 |
| Heavy Atoms | 23 |
| Complexity | 873.1507 |
Chemical Identifiers
| CAS Number | 438593-06-7 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)SCC(=O)C3=CC=C(C=C3)[N+](=O)[O-])N=CC=C2 |
Product Overview
1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone (CAS 438593-06-7), with molecular formula C17H12N2O3S and molecular weight 324.06 g/mol. IUPAC: 1-(4-nitrophenyl)-2-quinolin-8-ylsulfanylethanone.
Chemical Property Profile of 1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone
Property Insights of 1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone
The XLogP value of 4.118 indicates that 1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone. Following Lipinski's Rule of Five, 1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone 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 1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone?
The CAS number of 1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone is 438593-06-7.
What is the molecular formula of 1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone?
The molecular formula of 1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone is C17H12N2O3S.
What is the molecular weight of 1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone?
The molecular weight of 1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone is 324.06 g/mol.
Where can I buy 1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone?
You can request a quote for 1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Nitrophenyl)-2-(quinolin-8-ylsulfanyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.