3-(2-(4-Chlorophenyl)-2-oxoethylidene)-1,2,3,4-tetrahydroquinoxalin-2-one
TL;DR: 3-(2-(4-Chlorophenyl)-2-oxoethylidene)-1,2,3,4-tetrahydroquinoxalin-2-one (CAS 40598-92-3) is a chemical compound with molecular formula C16H11ClN2O2 and molecular weight 298.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-quinoxalin-2-one
Also Known As: 3-p-Chlorophenacyl-2(1H)-quinoxalinone, 3-[2-(4-chlorophenyl)-2-oxoethyl]-1,2-dihydroquinoxalin-2-one, 3-[2-(4-chlorophenyl)-2-oxoethyl]quinoxalin-2(1H)-one, 3-(2-(4-Chlorophenyl)-2-oxoethyl)quinoxalin-2(1H)-one, 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-quinoxalin-2-one
| Molecular Formula | C16H11ClN2O2 |
|---|---|
| Molecular Weight | 298.05 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 58.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.0509 |
| Heavy Atoms | 21 |
| Complexity | 455.0 |
Chemical Identifiers
| CAS Number | 40598-92-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=O)C(=N2)CC(=O)C3=CC=C(C=C3)Cl |
| InChIKey | PFUPENWSRATQRL-UHFFFAOYSA-N |
Product Overview
3-(2-(4-Chlorophenyl)-2-oxoethylidene)-1,2,3,4-tetrahydroquinoxalin-2-one (CAS 40598-92-3), with molecular formula C16H11ClN2O2 and molecular weight 298.05 g/mol. IUPAC: 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-quinoxalin-2-one.
Chemical Property Profile of 3-(2-(4-Chlorophenyl)-2-oxoethylidene)-1,2,3,4-tetrahydroquinoxalin-2-one
Property Insights of 3-(2-(4-Chlorophenyl)-2-oxoethylidene)-1,2,3,4-tetrahydroquinoxalin-2-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-(4-Chlorophenyl)-2-oxoethylidene)-1,2,3,4-tetrahydroquinoxalin-2-one. With a topological polar surface area (TPSA) of 58.5 Ų, 3-(2-(4-Chlorophenyl)-2-oxoethylidene)-1,2,3,4-tetrahydroquinoxalin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-(4-Chlorophenyl)-2-oxoethylidene)-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 3-(2-(4-Chlorophenyl)-2-oxoethylidene)-1,2,3,4-tetrahydroquinoxalin-2-one?
The CAS number of 3-(2-(4-Chlorophenyl)-2-oxoethylidene)-1,2,3,4-tetrahydroquinoxalin-2-one is 40598-92-3.
What is the molecular formula of 3-(2-(4-Chlorophenyl)-2-oxoethylidene)-1,2,3,4-tetrahydroquinoxalin-2-one?
The molecular formula of 3-(2-(4-Chlorophenyl)-2-oxoethylidene)-1,2,3,4-tetrahydroquinoxalin-2-one is C16H11ClN2O2.
What is the molecular weight of 3-(2-(4-Chlorophenyl)-2-oxoethylidene)-1,2,3,4-tetrahydroquinoxalin-2-one?
The molecular weight of 3-(2-(4-Chlorophenyl)-2-oxoethylidene)-1,2,3,4-tetrahydroquinoxalin-2-one is 298.05 g/mol.
Where can I buy 3-(2-(4-Chlorophenyl)-2-oxoethylidene)-1,2,3,4-tetrahydroquinoxalin-2-one?
You can request a quote for 3-(2-(4-Chlorophenyl)-2-oxoethylidene)-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 3-(2-(4-Chlorophenyl)-2-oxoethylidene)-1,2,3,4-tetrahydroquinoxalin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-(4-Chlorophenyl)-2-oxoethylidene)-1,2,3,4-tetrahydroquinoxalin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.