4-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one
TL;DR: 4-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one (CAS 931591-89-8) is a chemical compound with molecular formula C14H11N3O5S and molecular weight 333.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one
Also Known As: F1594-0007, 4-(4-nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one, 4-((4-nitrophenyl)sulfonyl)-3,4-dihydroquinoxalin-2(1H)-one, p-nitrophenyl(oxo)-3-oxo-1,2,3,4-tetrahydro-1-quinoxalinyl-lambda-sulfaniumolate
| Molecular Formula | C14H11N3O5S |
|---|---|
| Molecular Weight | 333.04 g/mol |
| LogP | 1.7422 |
| Topological Polar Surface Area | 109.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.04193 |
| Heavy Atoms | 23 |
| Complexity | 892.88367 |
Chemical Identifiers
| CAS Number | 931591-89-8 |
|---|---|
| SMILES | C1C(=O)NC2=CC=CC=C2N1S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
4-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one (CAS 931591-89-8), with molecular formula C14H11N3O5S and molecular weight 333.04 g/mol. IUPAC: 4-(4-nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one.
Chemical Property Profile of 4-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one
Property Insights of 4-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one
The XLogP value of 1.7422 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one. The TPSA of 109.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one. Following Lipinski's Rule of Five, 4-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one has 1 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-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one?
The CAS number of 4-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one is 931591-89-8.
What is the molecular formula of 4-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one?
The molecular formula of 4-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one is C14H11N3O5S.
What is the molecular weight of 4-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one?
The molecular weight of 4-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one is 333.04 g/mol.
Where can I buy 4-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one?
You can request a quote for 4-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Nitrophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.