2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone
TL;DR: 2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone (CAS 944779-57-1) is a chemical compound with molecular formula C16H19BrN2O2 and molecular weight 350.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone
Also Known As: AN-329/42286686, 2-(2-bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone, 2-bromo-4-isopropylphenyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-oxoethyl ether, 1-[(2-bromo-4-isopropylphenoxy)acetyl]-3,5-dimethyl-1H-pyrazole, 2-[2-bromo-4-(propan-2-yl)phenoxy]-1-(3,5-dimethyl-1H-pyrazol-1-yl)ethanone
| Molecular Formula | C16H19BrN2O2 |
|---|---|
| Molecular Weight | 350.06 g/mol |
| LogP | 4.10504 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.063 |
| Heavy Atoms | 21 |
| Complexity | 662.29175 |
Chemical Identifiers
| CAS Number | 944779-57-1 |
|---|---|
| SMILES | CC1=CC(=NN1C(=O)COC2=C(C=C(C=C2)C(C)C)Br)C |
Product Overview
2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone (CAS 944779-57-1), with molecular formula C16H19BrN2O2 and molecular weight 350.06 g/mol. IUPAC: 2-(2-bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone.
Chemical Property Profile of 2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone
Property Insights of 2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone
The XLogP value of 4.10504 indicates that 2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.12 Ų, 2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone has 0 hydrogen bond donor(s) and 3 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 2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone?
The CAS number of 2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone is 944779-57-1.
What is the molecular formula of 2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone?
The molecular formula of 2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone is C16H19BrN2O2.
What is the molecular weight of 2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone?
The molecular weight of 2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone is 350.06 g/mol.
Where can I buy 2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone?
You can request a quote for 2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Bromo-4-propan-2-ylphenoxy)-1-(3,5-dimethylpyrazol-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.