4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE
TL;DR: 4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE (CAS 1024068-64-1) is a chemical compound with molecular formula C20H18BrN5O2 and molecular weight 439.0644 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-bromo-1-methyl-5-[(5-methyl-1-phenyl-1,2,4-triazol-3-yl)oxymethyl]-2-phenylpyrazol-3-one
Also Known As: 4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE, 4-bromo-1-methyl-5-[(5-methyl-1-phenyl-1,2,4-triazol-3-yl)oxymethyl]-2-phenylpyrazol-3-one, 4-bromo-1-methyl-5-[(5-methyl-1-phenyl-1,2,4-triazol-3-yl)oxymethyl]-2-phenyl-pyrazol-3-one, 4-BROMO-1-METHYL-5-{[(5-METHYL-1-PHENYL-1,2,4-TRIAZOL-3-YL)OXY]METHYL}-2-PHENYLPYRAZOL-3-ONE, 4-bromo-1-methyl-5-{[(5-methyl-1-phenyl-1H-1,2,4-triazol-3-yl)oxy]methyl}-2-phenyl-2,3-dihydro-1H-pyrazol-3-one
Technical Specifications
| Molecular Formula | C20H18BrN5O2 |
| Molecular Weight | 439.0644 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 63.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 439.0644 Da |
| Heavy Atoms | 28 |
| Complexity | 603.0 |
| SMILES | CC1=NC(=NN1C2=CC=CC=C2)OCC3=C(C(=O)N(N3C)C4=CC=CC=C4)Br |
| InChIKey | AQBJEYODFAMPEM-UHFFFAOYSA-N |
Chemical Property Profile of 4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE
Property Insights of 4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE
The XLogP value of 4.5 indicates that 4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE. Following Lipinski's Rule of Five, 4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE 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
What is the CAS number of 4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE?
The CAS number of 4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE is 1024068-64-1.
What is the molecular formula of 4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE?
The molecular formula of 4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE is C20H18BrN5O2.
What is the molecular weight of 4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE?
The molecular weight of 4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE is 439.0644 g/mol.
Where can I buy 4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE?
You can request a quote for 4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE?
Yes, CoreyChem provides custom synthesis services for 4-BROMO-2-METHYL-3-((4-METHYL-3-PHENYL(2,3,5-TRIAZOLYLOXY))METHYL)-1-PHENYL-3-PYRAZOLIN-5-ONE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.