![6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione structure](/static/products/401/401466-91-9.png)
6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione
TL;DR: 6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione (CAS 401466-91-9) is a chemical compound with molecular formula C24H20N2O4 and molecular weight 400.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzyl-9,10-dimethoxy-6aH-isoindolo[2,3-a]quinazoline-5,11-dione
Also Known As: ML331 Analog, 6-benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione, 6-benzyl-9,10-dimethoxy-6aH-isoindolo[2,3-a]quinazoline-5,11-dione
| Molecular Formula | C24H20N2O4 |
|---|---|
| Molecular Weight | 400.14 g/mol |
| LogP | 4.0188 |
| Topological Polar Surface Area | 59.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.1423 |
| Heavy Atoms | 30 |
| Complexity | 1159.1224 |
Chemical Identifiers
| CAS Number | 401466-91-9 |
|---|---|
| SMILES | COC1=C(C2=C(C=C1)C3N(C(=O)C4=CC=CC=C4N3C2=O)CC5=CC=CC=C5)OC |
Product Overview
6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione (CAS 401466-91-9), with molecular formula C24H20N2O4 and molecular weight 400.14 g/mol. IUPAC: 6-benzyl-9,10-dimethoxy-6aH-isoindolo[2,3-a]quinazoline-5,11-dione.
Chemical Property Profile of 6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione
Property Insights of 6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione
The XLogP value of 4.0188 indicates that 6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.08 Ų, 6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione 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 6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione?
The CAS number of 6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione is 401466-91-9.
What is the molecular formula of 6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione?
The molecular formula of 6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione is C24H20N2O4.
What is the molecular weight of 6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione?
The molecular weight of 6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione is 400.14 g/mol.
Where can I buy 6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione?
You can request a quote for 6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-Benzyl-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.