![8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene structure](/static/products/7589/7589-57-3.webp)
8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene
TL;DR: 8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene (CAS 7589-57-3) is a chemical compound with molecular formula C9H5ClN4 and molecular weight 204.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene
Also Known As: 6-chloroimidazo[[?]]pyrido[[?]]pyridazine, 6-Chloroimidazo[1,2-b]pyrido[3,2-d]pyridazine, Imidazo[1,2-b]pyrido[3,2-d]pyridazine, 6-chloro-, 8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene
| Molecular Formula | C9H5ClN4 |
|---|---|
| Molecular Weight | 204.02 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 204.02028 |
| Heavy Atoms | 14 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 7589-57-3 |
|---|---|
| SMILES | C1=CC2=C(C(=NN3C2=NC=C3)Cl)N=C1 |
| InChIKey | SZFSCJWFJANENJ-UHFFFAOYSA-N |
Product Overview
8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene (CAS 7589-57-3), with molecular formula C9H5ClN4 and molecular weight 204.02 g/mol. IUPAC: 8-chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene.
Chemical Property Profile of 8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene
Property Insights of 8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene. With a topological polar surface area (TPSA) of 43.1 Ų, 8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene 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 8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene?
The CAS number of 8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene is 7589-57-3.
What is the molecular formula of 8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene?
The molecular formula of 8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene is C9H5ClN4.
What is the molecular weight of 8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene?
The molecular weight of 8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene is 204.02 g/mol.
Where can I buy 8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene?
You can request a quote for 8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene?
Yes, KEHONG BIO provides custom synthesis services for 8-Chloro-3,6,7,10-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,10,12-hexaene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.