1-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one
TL;DR: 1-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one (CAS 850730-72-2) is a chemical compound with molecular formula C15H17N3O3S and molecular weight 319.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one
Also Known As: 1-ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one, 1-ethyl-3-nitro-4-(thiomorpholin-4-yl)quinolin-2(1H)-one, 1-ethyl-3-nitro-4-thiomorpholinoquinolin-2(1H)-one, 1-Ethyl-3-nitro-4-thiomorpholin-4-yl-1H-quinolin-2-one, 1-ethyl-3-nitro-4-(1,4-thiazaperhydroin-4-yl)hydroquinolin-2-one
| Molecular Formula | C15H17N3O3S |
|---|---|
| Molecular Weight | 319.10 g/mol |
| LogP | 2.4828 |
| Topological Polar Surface Area | 68.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 319.09906 |
| Heavy Atoms | 22 |
| Complexity | 781.4317 |
Chemical Identifiers
| CAS Number | 850730-72-2 |
|---|---|
| SMILES | CCN1C2=CC=CC=C2C(=C(C1=O)[N+](=O)[O-])N3CCSCC3 |
Product Overview
1-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one (CAS 850730-72-2), with molecular formula C15H17N3O3S and molecular weight 319.10 g/mol. IUPAC: 1-ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one.
Chemical Property Profile of 1-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one
Property Insights of 1-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one
The XLogP value of 2.4828 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one. The TPSA of 68.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one. Following Lipinski's Rule of Five, 1-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one 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-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one?
The CAS number of 1-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one is 850730-72-2.
What is the molecular formula of 1-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one?
The molecular formula of 1-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one is C15H17N3O3S.
What is the molecular weight of 1-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one?
The molecular weight of 1-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one is 319.10 g/mol.
Where can I buy 1-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one?
You can request a quote for 1-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl-3-nitro-4-thiomorpholin-4-ylquinolin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.