2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide
TL;DR: 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide (CAS 1164114-67-3) is a chemical compound with molecular formula C10H14N4O2 and molecular weight 222.11168 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-cyanopropan-2-yl-[2-[2-cyanopropan-2-yl(oxido)amino]ethenyl]-oxoazanium
Also Known As: 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide, 2-cyanopropan-2-yl-[2-[2-cyanopropan-2-yl(oxido)amino]ethenyl]-oxoazanium, N,N'-bis(1-cyano-1-methylethyl)ethanediimine dioxide, 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6dioxide, 2-cyanopropan-2-yl-[2-[2-cyanopropan-2-yl(oxido)amino]ethenyl]-oxoammonium
Technical Specifications
| Molecular Formula | C10H14N4O2 |
| Molecular Weight | 222.11168 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 94.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 222.11168 Da |
| Heavy Atoms | 16 |
| Complexity | 368.0 |
| SMILES | CC(C)(C#N)N(C=C[N+](=O)C(C)(C)C#N)[O-] |
| InChIKey | NHBJWTRJPFBPNA-UHFFFAOYSA-N |
Chemical Property Profile of 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide
Property Insights of 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide. The TPSA of 94.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide. Following Lipinski's Rule of Five, 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide?
The CAS number of 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide is 1164114-67-3.
What is the molecular formula of 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide?
The molecular formula of 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide is C10H14N4O2.
What is the molecular weight of 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide?
The molecular weight of 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide is 222.11168 g/mol.
Where can I buy 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide?
You can request a quote for 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide?
Yes, CoreyChem provides custom synthesis services for 2,7-Dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.