5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione
TL;DR: 5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione (CAS 370841-33-1) is a chemical compound with molecular formula C23H22N2O6 and molecular weight 422.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(6,7-dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione
Also Known As: 5-(6,7-dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione, 5-(6,7-dimethoxy-4-oxo-4H-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)-1H-isoindole-1,3(2H)-dione, 5-(6,7-dimethoxy-4-oxo-4H-benzo[d][1,3]oxazin-2-yl)-2-isopentylisoindoline-1,3-dione, 5-(6,7-DIMETHOXY-4-OXO-4H-3,1-BENZOXAZIN-2-YL)-2-(3-METHYLBUTYL)-2,3-DIHYDRO-1H-ISOINDOLE-1,3-DIONE
| Molecular Formula | C23H22N2O6 |
|---|---|
| Molecular Weight | 422.15 g/mol |
| LogP | 3.5143 |
| Topological Polar Surface Area | 98.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 422.1478 |
| Heavy Atoms | 31 |
| Complexity | 1260.8917 |
Chemical Identifiers
| CAS Number | 370841-33-1 |
|---|---|
| SMILES | CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C3=NC4=CC(=C(C=C4C(=O)O3)OC)OC |
Product Overview
5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione (CAS 370841-33-1), with molecular formula C23H22N2O6 and molecular weight 422.15 g/mol. IUPAC: 5-(6,7-dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione.
Chemical Property Profile of 5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione
Property Insights of 5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione
The XLogP value of 3.5143 indicates that 5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione. Following Lipinski's Rule of Five, 5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione 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 5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione?
The CAS number of 5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione is 370841-33-1.
What is the molecular formula of 5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione?
The molecular formula of 5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione is C23H22N2O6.
What is the molecular weight of 5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione?
The molecular weight of 5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione is 422.15 g/mol.
Where can I buy 5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione?
You can request a quote for 5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-(6,7-Dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(3-methylbutyl)isoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.