![1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione structure](/static/products/800/80041-82-3.png)
1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione
TL;DR: 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione (CAS 80041-82-3) is a chemical compound with molecular formula C22H20BrNO6 and molecular weight 473.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione
Also Known As: 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione, 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyr
| Molecular Formula | C22H20BrNO6 |
|---|---|
| Molecular Weight | 473.05 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 74.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 473.0474 |
| Heavy Atoms | 30 |
| Complexity | 726.0 |
Chemical Identifiers
| CAS Number | 80041-82-3 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)CCN3C2=C(C(=O)C3=O)C4=CC(=C(C=C4Br)OC)OC)OC |
| InChIKey | QMZFKLSOJYNRSG-UHFFFAOYSA-N |
Product Overview
1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione (CAS 80041-82-3), with molecular formula C22H20BrNO6 and molecular weight 473.05 g/mol. IUPAC: 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione.
Chemical Property Profile of 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione
Property Insights of 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione
The XLogP value of 3.4 indicates that 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione. Following Lipinski's Rule of Five, 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione has 0 hydrogen bond donor(s) and 6 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-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione?
The CAS number of 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione is 80041-82-3.
What is the molecular formula of 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione?
The molecular formula of 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione is C22H20BrNO6.
What is the molecular weight of 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione?
The molecular weight of 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione is 473.05 g/mol.
Where can I buy 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione?
You can request a quote for 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-bromo-4,5-dimethoxyphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.