1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene
TL;DR: 1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene (CAS 5622-83-3) is a chemical compound with molecular formula C11H12N2 and molecular weight 172.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole
Also Known As: 1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole, 1,8-Diazatricyclo[7.4.0.0,2,7]trideca-2,4,6,8-tetraene, tetrahydropyrido[1,2-a]benzimidazole, Pyrido[1,2-a]benzimidazole, 1,2,3,4-tetrahydro- (6CI,7CI,8CI,9CI), 1,2,3,4-Tetrahydropyrido-[1,2-a] benzimidazole
| Molecular Formula | C11H12N2 |
|---|---|
| Molecular Weight | 172.10 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 17.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 172.10005 |
| Heavy Atoms | 13 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 5622-83-3 |
|---|---|
| SMILES | C1CCN2C(=NC3=CC=CC=C32)C1 |
| InChIKey | QHDDBWGHEWTMDV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene (CAS 5622-83-3), with molecular formula C11H12N2 and molecular weight 172.10 g/mol. IUPAC: 1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole.
Chemical Property Profile of 1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene
Property Insights of 1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene. With a topological polar surface area (TPSA) of 17.8 Ų, 1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene has 0 hydrogen bond donor(s) and 1 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 1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene?
The CAS number of 1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene is 5622-83-3.
What is the molecular formula of 1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene?
The molecular formula of 1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene is C11H12N2.
What is the molecular weight of 1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene?
The molecular weight of 1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene is 172.10 g/mol.
Where can I buy 1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene?
You can request a quote for 1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene?
Yes, KEHONG BIO provides custom synthesis services for 1,8-Diazatricyclo(7.4.0.0,2,7)trideca-2,4,6,8-tetraene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.