4-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one
TL;DR: 4-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one (CAS 556015-09-9) is a chemical compound with molecular formula C16H14N2O3S and molecular weight 314.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-2-phenylethenyl]sulfonyl-1,3-dihydroquinoxalin-2-one
Also Known As: 4-(2-phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one, 4-[(E)-2-phenylethenyl]sulfonyl-1,3-dihydroquinoxalin-2-one
| Molecular Formula | C16H14N2O3S |
|---|---|
| Molecular Weight | 314.07 g/mol |
| LogP | 2.4458 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 314.0725 |
| Heavy Atoms | 22 |
| Complexity | 829.47925 |
Chemical Identifiers
| CAS Number | 556015-09-9 |
|---|---|
| SMILES | C1C(=O)NC2=CC=CC=C2N1S(=O)(=O)/C=C/C3=CC=CC=C3 |
Product Overview
4-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one (CAS 556015-09-9), with molecular formula C16H14N2O3S and molecular weight 314.07 g/mol. IUPAC: 4-[(E)-2-phenylethenyl]sulfonyl-1,3-dihydroquinoxalin-2-one.
Chemical Property Profile of 4-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one
Property Insights of 4-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one
The XLogP value of 2.4458 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one. Following Lipinski's Rule of Five, 4-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one has 1 hydrogen bond donor(s) and 3 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-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one?
The CAS number of 4-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one is 556015-09-9.
What is the molecular formula of 4-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one?
The molecular formula of 4-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one is C16H14N2O3S.
What is the molecular weight of 4-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one?
The molecular weight of 4-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one is 314.07 g/mol.
Where can I buy 4-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one?
You can request a quote for 4-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-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-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Phenylethenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.