![(E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one structure](/static/products/328/328020-84-4.png)
(E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
TL;DR: (E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one (CAS 328020-84-4) is a chemical compound with molecular formula C17H21N7O and molecular weight 339.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-tert-butyl-8-[(E)-[4-(dimethylamino)phenyl]methylideneamino]-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-one
Also Known As: (E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one, F1252-1136, 6-tert-butyl-8-[(E)-{[4-(dimethylamino)phenyl]methylidene}amino]-7H,8H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-one, 6-tert-butyl-8-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one, 6-tert-butyl-8-[(E)-[4-(dimethylamino)phenyl]methylideneamino]-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-one
| Molecular Formula | C17H21N7O |
|---|---|
| Molecular Weight | 339.18 g/mol |
| LogP | 1.5317 |
| Topological Polar Surface Area | 80.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.18076 |
| Heavy Atoms | 25 |
| Complexity | 974.8844 |
Chemical Identifiers
| CAS Number | 328020-84-4 |
|---|---|
| SMILES | CC(C)(C)C1=NN2C=NN=C2N(C1=O)/N=C/C3=CC=C(C=C3)N(C)C |
Product Overview
(E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one (CAS 328020-84-4), with molecular formula C17H21N7O and molecular weight 339.18 g/mol. IUPAC: 6-tert-butyl-8-[(E)-[4-(dimethylamino)phenyl]methylideneamino]-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-one.
Chemical Property Profile of (E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
Property Insights of (E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
The XLogP value of 1.5317 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one. The TPSA of 80.68 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one. Following Lipinski's Rule of Five, (E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one has 0 hydrogen bond donor(s) and 6 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 (E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one?
The CAS number of (E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one is 328020-84-4.
What is the molecular formula of (E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one?
The molecular formula of (E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one is C17H21N7O.
What is the molecular weight of (E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one?
The molecular weight of (E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one is 339.18 g/mol.
Where can I buy (E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one?
You can request a quote for (E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-6-(tert-butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.