bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane
TL;DR: bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane (CAS 308289-73-8) is a chemical compound with molecular formula C18H26N4Se and molecular weight 378.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3,5-dimethyl-1-(2-methylprop-2-enyl)pyrazol-4-yl]selanyl-3,5-dimethyl-1-(2-methylprop-2-enyl)pyrazole
Also Known As: bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane, 4,4'-selanylbis[3,5-dimethyl-1-(2-methylprop-2-en-1-yl)-1H-pyrazole], 4-[3,5-dimethyl-1-(2-methylprop-2-enyl)pyrazol-4-yl]selanyl-3,5-dimethyl-1-(2-methylprop-2-enyl)pyrazole
| Molecular Formula | C18H26N4Se |
|---|---|
| Molecular Weight | 378.13 g/mol |
| LogP | 2.12048 |
| Topological Polar Surface Area | 35.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 378.13226 |
| Heavy Atoms | 23 |
| Complexity | 700.319 |
Chemical Identifiers
| CAS Number | 308289-73-8 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=C)C)C)[Se]C2=C(N(N=C2C)CC(=C)C)C |
Product Overview
bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane (CAS 308289-73-8), with molecular formula C18H26N4Se and molecular weight 378.13 g/mol. IUPAC: 4-[3,5-dimethyl-1-(2-methylprop-2-enyl)pyrazol-4-yl]selanyl-3,5-dimethyl-1-(2-methylprop-2-enyl)pyrazole.
Chemical Property Profile of bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane
Property Insights of bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane
The XLogP value of 2.12048 suggests moderate lipophilicity, balancing water solubility and membrane permeability for bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane. With a topological polar surface area (TPSA) of 35.64 Ų, bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane has 0 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 bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane?
The CAS number of bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane is 308289-73-8.
What is the molecular formula of bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane?
The molecular formula of bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane is C18H26N4Se.
What is the molecular weight of bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane?
The molecular weight of bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane is 378.13 g/mol.
Where can I buy bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane?
You can request a quote for bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane?
Yes, KEHONG BIO provides custom synthesis services for bis(3,5-dimethyl-1-(2-methylallyl)-1H-pyrazol-4-yl)selane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.