3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole
TL;DR: 3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole (CAS 1042767-99-6) is a chemical compound with molecular formula C8H7BrN2S and molecular weight 241.95132 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole
Also Known As: 3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole, 3-(5-bromo-2-thienyl)-5-methyl-1H-pyrazole, 1Y-0835
Technical Specifications
| Molecular Formula | C8H7BrN2S |
| Molecular Weight | 241.95132 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 56.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 241.95132 Da |
| Heavy Atoms | 12 |
| Complexity | 167.0 |
| SMILES | CC1=CC(=NN1)C2=CC=C(S2)Br |
| InChIKey | UGKOTLIWHZZSPK-UHFFFAOYSA-N |
Chemical Property Profile of 3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole
Property Insights of 3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole
The XLogP value of 3.0 indicates that 3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.9 Ų, 3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole?
The CAS number of 3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole is 1042767-99-6.
What is the molecular formula of 3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole?
The molecular formula of 3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole is C8H7BrN2S.
What is the molecular weight of 3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole?
The molecular weight of 3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole is 241.95132 g/mol.
Where can I buy 3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole?
You can request a quote for 3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole?
Yes, CoreyChem provides custom synthesis services for 3-(5-bromothiophen-2-yl)-5-methyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.