3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one
TL;DR: 3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one (CAS 375834-86-9) is a chemical compound with molecular formula C20H19N3O4 and molecular weight 365.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one
Also Known As: BAS 01403801, 3,3-dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one, 1-Allyl-3,3-dimethyl-4-(3-nitro-benzoyl)-3,4-dihydro-1H-quinoxalin-2-one, 1-allyl-3,3-dimethyl-4-(3-nitrobenzoyl)-3,4-dihydroquinoxalin-2(1H)-one, 3,3-DIMETHYL-4-(3-NITROBENZOYL)-1-(PROP-2-EN-1-YL)-1,2,3,4-TETRAHYDROQUINOXALIN-2-ONE
| Molecular Formula | C20H19N3O4 |
|---|---|
| Molecular Weight | 365.14 g/mol |
| LogP | 3.5528 |
| Topological Polar Surface Area | 83.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 365.13754 |
| Heavy Atoms | 27 |
| Complexity | 951.7479 |
Chemical Identifiers
| CAS Number | 375834-86-9 |
|---|---|
| SMILES | CC1(C(=O)N(C2=CC=CC=C2N1C(=O)C3=CC(=CC=C3)[N+](=O)[O-])CC=C)C |
Product Overview
3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one (CAS 375834-86-9), with molecular formula C20H19N3O4 and molecular weight 365.14 g/mol. IUPAC: 3,3-dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one.
Chemical Property Profile of 3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one
Property Insights of 3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one
The XLogP value of 3.5528 indicates that 3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-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 3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one. Following Lipinski's Rule of Five, 3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-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 3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one?
The CAS number of 3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one is 375834-86-9.
What is the molecular formula of 3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one?
The molecular formula of 3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one is C20H19N3O4.
What is the molecular weight of 3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one?
The molecular weight of 3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one is 365.14 g/mol.
Where can I buy 3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one?
You can request a quote for 3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dimethyl-4-(3-nitrobenzoyl)-1-prop-2-enylquinoxalin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.