![3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione structure](/static/products/676/676581-41-2.png)
3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione
TL;DR: 3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione (CAS 676581-41-2) is a chemical compound with molecular formula C16H16N4O4 and molecular weight 328.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-13,14-dimethoxy-1,4,5,8-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-2(6),3,10(15),11,13-pentaene-7,16-dione
Also Known As: 3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione
| Molecular Formula | C16H16N4O4 |
|---|---|
| Molecular Weight | 328.12 g/mol |
| LogP | 1.3226 |
| Topological Polar Surface Area | 85.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.11716 |
| Heavy Atoms | 24 |
| Complexity | 873.20264 |
Chemical Identifiers
| CAS Number | 676581-41-2 |
|---|---|
| SMILES | CCN1C2=C(C=N1)N3C(C4=C(C3=O)C(=C(C=C4)OC)OC)NC2=O |
Product Overview
3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione (CAS 676581-41-2), with molecular formula C16H16N4O4 and molecular weight 328.12 g/mol. IUPAC: 5-ethyl-13,14-dimethoxy-1,4,5,8-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-2(6),3,10(15),11,13-pentaene-7,16-dione.
Chemical Property Profile of 3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione
Property Insights of 3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione
The XLogP value of 1.3226 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione. The TPSA of 85.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione. Following Lipinski's Rule of Five, 3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione has 1 hydrogen bond donor(s) and 5 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-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione?
The CAS number of 3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione is 676581-41-2.
What is the molecular formula of 3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione?
The molecular formula of 3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione is C16H16N4O4.
What is the molecular weight of 3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione?
The molecular weight of 3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione is 328.12 g/mol.
Where can I buy 3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione?
You can request a quote for 3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-ethyl-8,9-dimethoxy-5,5a-dihydro-3H-pyrazolo[3',4':5,6]pyrimido[2,1-a]isoindole-4,10-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.