1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one
TL;DR: 1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one (CAS 683211-26-9) is a chemical compound with molecular formula C16H14N4O and molecular weight 278.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,6-diphenyl-1H-1,2,4,5-tetrazin-2-yl)ethanone
Also Known As: 1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one, 1-(3,6-diphenyl-1,2,4,5-tetrazin-1(4H)-yl)ethanone, 1-(3,6-diphenyl-1H-1,2,4,5-tetrazin-2-yl)ethanone, 1-(3,6-diphenyl-2H-1,2,4,5-tetrazin-1-yl)ethanone, 1-acetyl-3,6-diphenyl-1,4-dihydro-1,2,4,5-tetrazine
| Molecular Formula | C16H14N4O |
|---|---|
| Molecular Weight | 278.12 g/mol |
| LogP | 2.1617 |
| Topological Polar Surface Area | 57.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.11676 |
| Heavy Atoms | 21 |
| Complexity | 707.57153 |
Chemical Identifiers
| CAS Number | 683211-26-9 |
|---|---|
| SMILES | CC(=O)N1C(=NN=C(N1)C2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one (CAS 683211-26-9), with molecular formula C16H14N4O and molecular weight 278.12 g/mol. IUPAC: 1-(3,6-diphenyl-1H-1,2,4,5-tetrazin-2-yl)ethanone.
Chemical Property Profile of 1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one
Property Insights of 1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one
The XLogP value of 2.1617 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one. With a topological polar surface area (TPSA) of 57.06 Ų, 1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one has 1 hydrogen bond donor(s) and 4 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-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one?
The CAS number of 1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one is 683211-26-9.
What is the molecular formula of 1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one?
The molecular formula of 1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one is C16H14N4O.
What is the molecular weight of 1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one?
The molecular weight of 1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one is 278.12 g/mol.
Where can I buy 1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one?
You can request a quote for 1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,6-Diphenyl-1,2,4,5-tetrazin-1(2H)-yl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.