3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole
TL;DR: 3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole (CAS 650592-10-2) is a chemical compound with molecular formula C12H7Cl2F3N4O2S2 and molecular weight 429.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-(4,5-dichloroimidazol-1-yl)sulfonylthiophen-2-yl]-1-methyl-5-(trifluoromethyl)pyrazole
Also Known As: 3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole, 3-[5-(4,5-dichloroimidazol-1-yl)sulfonylthiophen-2-yl]-1-methyl-5-(trifluoromethyl)pyrazole, 3-(5-[(4,5-DICHLORO-1H-IMIDAZOL-1-YL)SULFONYL]-2-THIENYL)-1-METHYL-5-(TRIFLUOROMETHYL)-1H-PYRAZOLE, 3-[5-(4,5-dichloroimidazol-1-ylsulfonyl)thiophen-2-yl]-1-methyl-5-(trifluoromethyl)pyrazole, 3-{5-[(4,5-dichloro-1h-imidazol-1-yl)sulfonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1h-pyrazole
| Molecular Formula | C12H7Cl2F3N4O2S2 |
|---|---|
| Molecular Weight | 429.93 g/mol |
| LogP | 3.9077 |
| Topological Polar Surface Area | 69.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 429.93396 |
| Heavy Atoms | 25 |
| Complexity | 1053.0358 |
Chemical Identifiers
| CAS Number | 650592-10-2 |
|---|---|
| SMILES | CN1C(=CC(=N1)C2=CC=C(S2)S(=O)(=O)N3C=NC(=C3Cl)Cl)C(F)(F)F |
Product Overview
3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole (CAS 650592-10-2), with molecular formula C12H7Cl2F3N4O2S2 and molecular weight 429.93 g/mol. IUPAC: 3-[5-(4,5-dichloroimidazol-1-yl)sulfonylthiophen-2-yl]-1-methyl-5-(trifluoromethyl)pyrazole.
Chemical Property Profile of 3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole
Property Insights of 3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole
The XLogP value of 3.9077 indicates that 3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole. Following Lipinski's Rule of Five, 3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole 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
Frequently Asked Questions
What is the CAS number of 3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole?
The CAS number of 3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole is 650592-10-2.
What is the molecular formula of 3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole?
The molecular formula of 3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole is C12H7Cl2F3N4O2S2.
What is the molecular weight of 3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole?
The molecular weight of 3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole is 429.93 g/mol.
Where can I buy 3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole?
You can request a quote for 3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 3-{5-[(4,5-dichloro-1H-imidazol-1-yl)sulphonyl]-2-thienyl}-1-methyl-5-(trifluoromethyl)-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.