![[4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone structure](/static/products/1005/1005667-34-4.webp)
[4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone
TL;DR: [4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone (CAS 1005667-34-4) is a chemical compound with molecular formula C11H10BrF5N4O2 and molecular weight 403.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-bromo-1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]methanone
Also Known As: [4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone, [4-bromo-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]methanone, 1-{[4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]carbonyl}-5-(difluoromethyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-ol
| Molecular Formula | C11H10BrF5N4O2 |
|---|---|
| Molecular Weight | 403.99 g/mol |
| LogP | 2.3769 |
| Topological Polar Surface Area | 70.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 403.99072 |
| Heavy Atoms | 23 |
| Complexity | 686.6921 |
Chemical Identifiers
| CAS Number | 1005667-34-4 |
|---|---|
| SMILES | CC1=NN(C(C1)(C(F)F)O)C(=O)C2=C(C(=NN2C)C(F)(F)F)Br |
Product Overview
[4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone (CAS 1005667-34-4), with molecular formula C11H10BrF5N4O2 and molecular weight 403.99 g/mol. IUPAC: [4-bromo-1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]methanone.
Chemical Property Profile of [4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone
Property Insights of [4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone
The XLogP value of 2.3769 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone. The TPSA of 70.72 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone. Following Lipinski's Rule of Five, [4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone has 1 hydrogen bond donor(s) and 4 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 [4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone?
The CAS number of [4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone is 1005667-34-4.
What is the molecular formula of [4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone?
The molecular formula of [4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone is C11H10BrF5N4O2.
What is the molecular weight of [4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone?
The molecular weight of [4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone is 403.99 g/mol.
Where can I buy [4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone?
You can request a quote for [4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone?
Yes, KEHONG BIO provides custom synthesis services for [4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl][5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.