![7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione structure](/static/products/3317/331760-63-5.webp)
7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione
TL;DR: 7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione (CAS 331760-63-5) is a chemical compound with molecular formula C17H12N2O2S and molecular weight 308.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-thia-1,12-diazapentacyclo[11.7.0.02,10.04,9.014,19]icosa-2(10),4(9),12,14,16,18-hexaene-11,20-dione
Also Known As: BAS 00584475, AH-262/36337011, 7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione, [1]Benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione, 7,8,9,10-tetrahydro-, 7,8,9,10-Tetrahydro-11-thia-5,11b-diaza-indeno[2,1-a]fluorene-6,12-dione
| Molecular Formula | C17H12N2O2S |
|---|---|
| Molecular Weight | 308.06 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 78.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 308.06195 |
| Heavy Atoms | 22 |
| Complexity | 575.0 |
Chemical Identifiers
| CAS Number | 331760-63-5 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N4C(=NC3=O)C5=CC=CC=C5C4=O |
| InChIKey | BQJVAODAWLSKRC-UHFFFAOYSA-N |
Product Overview
7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione (CAS 331760-63-5), with molecular formula C17H12N2O2S and molecular weight 308.06 g/mol. IUPAC: 3-thia-1,12-diazapentacyclo[11.7.0.02,10.04,9.014,19]icosa-2(10),4(9),12,14,16,18-hexaene-11,20-dione.
Chemical Property Profile of 7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione
Property Insights of 7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione
The XLogP value of 3.3 indicates that 7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione. Following Lipinski's Rule of Five, 7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione has 0 hydrogen bond donor(s) and 3 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 7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione?
The CAS number of 7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione is 331760-63-5.
What is the molecular formula of 7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione?
The molecular formula of 7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione is C17H12N2O2S.
What is the molecular weight of 7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione?
The molecular weight of 7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione is 308.06 g/mol.
Where can I buy 7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione?
You can request a quote for 7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione?
Yes, KEHONG BIO provides custom synthesis services for 7,8,9,10-Tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindole-6,13-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.