4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione
TL;DR: 4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione (CAS 124756-24-7) is a chemical compound with molecular formula C17H21NO7 and molecular weight 351.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-diethyl-2-(3,4,5-trimethoxybenzoyl)-1,2-oxazolidine-3,5-dione
Also Known As: 2-Dmbdi, 2-(3,4,5-Trimethoxybenzoyl)-4,4-diethyl-3,5-isoxazolidinedione, 4,4-diethyl-2-(3,4,5-trimethoxybenzoyl)-1,2-oxazolidine-3,5-dione, 4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione, 3,5-Isoxazolidinedione,4,4-diethyl-2-(3,4,5-trimethoxybenzoyl)-
| Molecular Formula | C17H21NO7 |
|---|---|
| Molecular Weight | 351.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 91.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 351.1318 |
| Heavy Atoms | 25 |
| Complexity | 517.0 |
Chemical Identifiers
| CAS Number | 124756-24-7 |
|---|---|
| SMILES | CCC1(C(=O)N(OC1=O)C(=O)C2=CC(=C(C(=C2)OC)OC)OC)CC |
| InChIKey | RSRCCEHOSDDIPD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione (CAS 124756-24-7), with molecular formula C17H21NO7 and molecular weight 351.13 g/mol. IUPAC: 4,4-diethyl-2-(3,4,5-trimethoxybenzoyl)-1,2-oxazolidine-3,5-dione.
Chemical Property Profile of 4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione
Property Insights of 4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione. The TPSA of 91.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione. Following Lipinski's Rule of Five, 4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione has 0 hydrogen bond donor(s) and 7 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 4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione?
The CAS number of 4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione is 124756-24-7.
What is the molecular formula of 4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione?
The molecular formula of 4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione is C17H21NO7.
What is the molecular weight of 4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione?
The molecular weight of 4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione is 351.13 g/mol.
Where can I buy 4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione?
You can request a quote for 4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione?
Yes, KEHONG BIO provides custom synthesis services for 4,4-Diethyl-2-(3,4,5-trimethoxybenzoyl)-3,5-isoxazolidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.