![4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide structure](/static/products/1005/1005576-59-9.webp)
4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide
TL;DR: 4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide (CAS 1005576-59-9) is a chemical compound with molecular formula C21H22BrN3O2 and molecular weight 427.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-[3-[(3,5-dimethylphenoxy)methyl]phenyl]-1-ethylpyrazole-5-carboxamide
Also Known As: 4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide, 4-Bromo-N-[3-[(3,5-dimethylphenoxy)methyl]phenyl]-1-ethyl-1H-pyrazole-5-carboxamide, 4-bromo-N-[3-[(3,5-dimethylphenoxy)methyl]phenyl]-2-ethyl-pyrazole-3-carboxamide, 4-bromo-N-[3-[(3,5-dimethylphenoxy)methyl]phenyl]-2-ethylpyrazole-3-carboxamide
| Molecular Formula | C21H22BrN3O2 |
|---|---|
| Molecular Weight | 427.09 g/mol |
| LogP | 5.11364 |
| Topological Polar Surface Area | 56.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 427.08954 |
| Heavy Atoms | 27 |
| Complexity | 945.5606 |
Chemical Identifiers
| CAS Number | 1005576-59-9 |
|---|---|
| SMILES | CCN1C(=C(C=N1)Br)C(=O)NC2=CC=CC(=C2)COC3=CC(=CC(=C3)C)C |
Product Overview
4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide (CAS 1005576-59-9), with molecular formula C21H22BrN3O2 and molecular weight 427.09 g/mol. IUPAC: 4-bromo-N-[3-[(3,5-dimethylphenoxy)methyl]phenyl]-1-ethylpyrazole-5-carboxamide.
Chemical Property Profile of 4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide
Property Insights of 4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide
The XLogP value of 5.11364 indicates that 4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.15 Ų, 4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide?
The CAS number of 4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide is 1005576-59-9.
What is the molecular formula of 4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide?
The molecular formula of 4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide is C21H22BrN3O2.
What is the molecular weight of 4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide?
The molecular weight of 4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide is 427.09 g/mol.
Where can I buy 4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide?
You can request a quote for 4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-{3-[(3,5-dimethylphenoxy)methyl]phenyl}-1-ethyl-1H-pyrazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.