1-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one
TL;DR: 1-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one (CAS 6036-43-7) is a chemical compound with molecular formula C24H21N3O4 and molecular weight 415.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one
Also Known As: BIM-0036444.P001, 1-benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one, 1-benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)-3,4-dihydroquinoxalin-2(1H)-one, 1-BENZYL-3,3-DIMETHYL-4-(4-NITROBENZOYL)-1,2,3,4-TETRAHYDROQUINOXALIN-2-ONE, 1-benzyl-3,3-dimethyl-4-[(4-nitrophenyl)carbonyl]-3,4-dihydroquinoxalin-2(1H)-one
| Molecular Formula | C24H21N3O4 |
|---|---|
| Molecular Weight | 415.15 g/mol |
| LogP | 4.567 |
| Topological Polar Surface Area | 83.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 415.1532 |
| Heavy Atoms | 31 |
| Complexity | 1156.9567 |
Chemical Identifiers
| CAS Number | 6036-43-7 |
|---|---|
| SMILES | CC1(C(=O)N(C2=CC=CC=C2N1C(=O)C3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=CC=C4)C |
Product Overview
1-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one (CAS 6036-43-7), with molecular formula C24H21N3O4 and molecular weight 415.15 g/mol. IUPAC: 1-benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one.
Chemical Property Profile of 1-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one
Property Insights of 1-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one
The XLogP value of 4.567 indicates that 1-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one. Following Lipinski's Rule of Five, 1-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one 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 1-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one?
The CAS number of 1-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one is 6036-43-7.
What is the molecular formula of 1-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one?
The molecular formula of 1-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one is C24H21N3O4.
What is the molecular weight of 1-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one?
The molecular weight of 1-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one is 415.15 g/mol.
Where can I buy 1-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one?
You can request a quote for 1-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-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-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-3,3-dimethyl-4-(4-nitrobenzoyl)quinoxalin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.