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[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
Fine Chemical

[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 403.99072 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[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

CAS Number
1005667-34-4
Molecular Formula
C11H10BrF5N4O2
Molecular Weight
403.99072 g/mol
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Technical Specifications

Molecular FormulaC11H10BrF5N4O2
Molecular Weight403.99072 g/mol
XLogP2.1
Topological Polar Surface Area (TPSA)70.7 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors9
Rotatable Bonds2
Exact Mass403.99072 Da
Heavy Atoms23
Complexity531.0
SMILESCC1=NN(C(C1)(C(F)F)O)C(=O)C2=C(C(=NN2C)C(F)(F)F)Br
InChIKeyWUPVLSBOQLIAJT-UHFFFAOYSA-N

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

XLogP
2.1
TPSA (Topological Polar Surface Area)
70.7
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
9
Rotatable Bonds
2
Heavy Atoms
23
Complexity
531.0
Exact Mass
403.99072
Monoisotopic Mass
403.99072
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

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 2.1 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 70.7 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 9 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-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 403.99072 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 CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem 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, CoreyChem 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.

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