3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine
TL;DR: 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine (CAS 68614-65-3) is a chemical compound with molecular formula C6H12N4 and molecular weight 140.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-diethyl-1,4-dihydro-1,2,4,5-tetrazine
Also Known As: 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine, 3,6-diethyl-1,4-dihydro-1,2,4,5-tetrazine, 1,2,4,5-Tetrazine, 3,6-diethyl-1,2-dihydro-, 1,2,4,5-Tetrazine, 3,6-diethyl-1,4-dihydro-, 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetraazine #
| Molecular Formula | C6H12N4 |
|---|---|
| Molecular Weight | 140.11 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 48.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 140.1062 |
| Heavy Atoms | 10 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 68614-65-3 |
|---|---|
| SMILES | CCC1=NNC(=NN1)CC |
| InChIKey | VRBPMSYSMGCTSP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine (CAS 68614-65-3), with molecular formula C6H12N4 and molecular weight 140.11 g/mol. IUPAC: 3,6-diethyl-1,4-dihydro-1,2,4,5-tetrazine.
Chemical Property Profile of 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine
Property Insights of 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine. With a topological polar surface area (TPSA) of 48.8 Ų, 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine has 2 hydrogen bond donor(s) and 2 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 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine?
The CAS number of 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine is 68614-65-3.
What is the molecular formula of 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine?
The molecular formula of 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine is C6H12N4.
What is the molecular weight of 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine?
The molecular weight of 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine is 140.11 g/mol.
Where can I buy 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine?
You can request a quote for 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Diethyl-1,2-dihydro-1,2,4,5-tetrazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.