4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole
TL;DR: 4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole (CAS 108221-12-1) is a chemical compound with molecular formula C15H22N2 and molecular weight 230.1783 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(1-adamantyl)-3,5-dimethyl-1H-pyrazole
Also Known As: 4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole, 4-(1-adamantyl)-3,5-dimethyl-1H-pyrazole, TimTec1_006468, 4-Adamantan-1-yl-3,5-dimethyl-1H-pyrazole, 4-adamantyl-3,5-dimethylpyrazole
Technical Specifications
| Molecular Formula | C15H22N2 |
| Molecular Weight | 230.1783 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 230.1783 Da |
| Heavy Atoms | 17 |
| Complexity | 284.0 |
| SMILES | CC1=C(C(=NN1)C)C23CC4CC(C2)CC(C4)C3 |
| InChIKey | SFFIZXMQASIFMI-UHFFFAOYSA-N |
Chemical Property Profile of 4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole
Property Insights of 4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole
The XLogP value of 4.4 indicates that 4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.7 Ų, 4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole?
The CAS number of 4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole is 108221-12-1.
What is the molecular formula of 4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole?
The molecular formula of 4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole is C15H22N2.
What is the molecular weight of 4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole?
The molecular weight of 4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole is 230.1783 g/mol.
Where can I buy 4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole?
You can request a quote for 4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole?
Yes, CoreyChem provides custom synthesis services for 4-(Adamantan-1-yl)-3,5-dimethyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.