![5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid structure](/static/products/874/874787-48-1.png)
5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid
TL;DR: 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid (CAS 874787-48-1) is a chemical compound with molecular formula C8H4N2O2S2 and molecular weight 223.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,9-dithia-1,7-diazatricyclo[6.3.0.02,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid
Also Known As: 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid, thieno[2',3':4,5]imidazo[2,1-b][1,3]thiazole-2-carboxylic acid, 5,9-dithia-1,7-diazatricyclo[6.3.0.0?,?]undeca-2(6),3,7,10-tetraene-4-carboxylic acid, 5,9-dithia-1,7-diazatricyclo(6.3.0.0,2,6)undeca-2(6),3,7,10-tetraene-4-carboxylic acid, 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylicacid
| Molecular Formula | C8H4N2O2S2 |
|---|---|
| Molecular Weight | 223.97 g/mol |
| LogP | 2.3087 |
| Topological Polar Surface Area | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 223.97142 |
| Heavy Atoms | 14 |
| Complexity | 633.9284 |
Chemical Identifiers
| CAS Number | 874787-48-1 |
|---|---|
| SMILES | C1=CSC2=NC3=C(N21)C=C(S3)C(=O)O |
Product Overview
5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid (CAS 874787-48-1), with molecular formula C8H4N2O2S2 and molecular weight 223.97 g/mol. IUPAC: 5,9-dithia-1,7-diazatricyclo[6.3.0.02,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid.
Chemical Property Profile of 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid
Property Insights of 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid
The XLogP value of 2.3087 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid. With a topological polar surface area (TPSA) of 54.6 Ų, 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid has 1 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 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid?
The CAS number of 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid is 874787-48-1.
What is the molecular formula of 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid?
The molecular formula of 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid is C8H4N2O2S2.
What is the molecular weight of 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid?
The molecular weight of 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid is 223.97 g/mol.
Where can I buy 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid?
You can request a quote for 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.