Dodecahydro-1,4,7,9b-tetraazaphenalene
TL;DR: Dodecahydro-1,4,7,9b-tetraazaphenalene (CAS 10553-85-2) is a chemical compound with molecular formula C9H18N4 and molecular weight 182.15315 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,6,10,13-tetrazatricyclo[7.3.1.05,13]tridecane
Also Known As: Dodecahydro-1,4,7,9b-tetraazaphenalene, DODECAHYDRO-1,4,7,9B-TETRAAZOPHENALENE, Dodecahydro-1,4,7,9b-tetrazaphenalin, 1,4,7,9B-Tetraazaphenalene, dodecahydro-, Dodecahydro-1,7,9b-tetrazaphenalin
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H18N4 |
| Molecular Weight | 182.15315 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 39.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 182.15315 Da |
| Heavy Atoms | 13 |
| Complexity | 163.0 |
| SMILES | C1CNC2CCNC3N2C1NCC3 |
| InChIKey | ZNJURNUHQCGRLX-UHFFFAOYSA-N |
Chemical Property Profile of Dodecahydro-1,4,7,9b-tetraazaphenalene
Property Insights of Dodecahydro-1,4,7,9b-tetraazaphenalene
The XLogP value of -0.1 indicates that Dodecahydro-1,4,7,9b-tetraazaphenalene is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 39.3 Ų, Dodecahydro-1,4,7,9b-tetraazaphenalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dodecahydro-1,4,7,9b-tetraazaphenalene has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Dodecahydro-1,4,7,9b-tetraazaphenalene?
The CAS number of Dodecahydro-1,4,7,9b-tetraazaphenalene is 10553-85-2.
What is the molecular formula of Dodecahydro-1,4,7,9b-tetraazaphenalene?
The molecular formula of Dodecahydro-1,4,7,9b-tetraazaphenalene is C9H18N4.
What is the molecular weight of Dodecahydro-1,4,7,9b-tetraazaphenalene?
The molecular weight of Dodecahydro-1,4,7,9b-tetraazaphenalene is 182.15315 g/mol.
Where can I buy Dodecahydro-1,4,7,9b-tetraazaphenalene?
You can request a quote for Dodecahydro-1,4,7,9b-tetraazaphenalene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dodecahydro-1,4,7,9b-tetraazaphenalene?
Yes, CoreyChem provides custom synthesis services for Dodecahydro-1,4,7,9b-tetraazaphenalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.