1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)-
TL;DR: 1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)- (CAS 110076-36-3) is a chemical compound with molecular formula C15H33N3 and molecular weight 255.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4,7-tri(propan-2-yl)-1,4,7-triazonane
Also Known As: 1,4,7-tri(propan-2-yl)-1,4,7-triazonane, 1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)-, 1,4,7-tris(propan-2-yl)-1,4,7-triazonane, 1,4,7-triisopropyl-1,4,7-triazacyclononane, 1,4,7-tripropan-2-yl-1,4,7-triazonane
| Molecular Formula | C15H33N3 |
|---|---|
| Molecular Weight | 255.27 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 9.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 255.26744 |
| Heavy Atoms | 18 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 110076-36-3 |
|---|---|
| SMILES | CC(C)N1CCN(CCN(CC1)C(C)C)C(C)C |
| InChIKey | UUBBDZVLOQSJSB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)- (CAS 110076-36-3), with molecular formula C15H33N3 and molecular weight 255.27 g/mol. IUPAC: 1,4,7-tri(propan-2-yl)-1,4,7-triazonane.
Chemical Property Profile of 1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)-
Property Insights of 1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)-. With a topological polar surface area (TPSA) of 9.7 Ų, 1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)- 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 1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)-?
The CAS number of 1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)- is 110076-36-3.
What is the molecular formula of 1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)-?
The molecular formula of 1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)- is C15H33N3.
What is the molecular weight of 1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)-?
The molecular weight of 1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)- is 255.27 g/mol.
Where can I buy 1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)-?
You can request a quote for 1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.