Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl-
TL;DR: Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl- (CAS 19803-53-3) is a chemical compound with molecular formula C16H12N2O3 and molecular weight 280.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-methyl-4-oxido-1-oxoquinoxalin-1-ium-2-yl)-phenylmethanone
Also Known As: 2-benzoyl-3-methylquinoxaline 1,4-dioxide, Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl-, J2.693.171A, (3-methyl-1,4-dioxido-2-quinoxalinyl)(phenyl)methanone, I14-23972
| Molecular Formula | C16H12N2O3 |
|---|---|
| Molecular Weight | 280.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 63.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 280.08478 |
| Heavy Atoms | 21 |
| Complexity | 480.0 |
Chemical Identifiers
| CAS Number | 19803-53-3 |
|---|---|
| SMILES | CC1=C([N+](=O)C2=CC=CC=C2N1[O-])C(=O)C3=CC=CC=C3 |
| InChIKey | XFBLYNKNXQDAOQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl- (CAS 19803-53-3), with molecular formula C16H12N2O3 and molecular weight 280.08 g/mol. IUPAC: (3-methyl-4-oxido-1-oxoquinoxalin-1-ium-2-yl)-phenylmethanone.
Chemical Property Profile of Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl-
Property Insights of Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl-. The TPSA of 63.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl-. Following Lipinski's Rule of Five, Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl- has 0 hydrogen bond donor(s) and 4 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 Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl-?
The CAS number of Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl- is 19803-53-3.
What is the molecular formula of Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl-?
The molecular formula of Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl- is C16H12N2O3.
What is the molecular weight of Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl-?
The molecular weight of Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl- is 280.08 g/mol.
Where can I buy Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl-?
You can request a quote for Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl-?
Yes, KEHONG BIO provides custom synthesis services for Methanone, (3-methyl-1,4-dioxido-2-quinoxalinyl)phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.