![4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol structure](/static/products/371/371228-69-2.png)
4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol
TL;DR: 4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol (CAS 371228-69-2) is a chemical compound with molecular formula C20H15BrN6O and molecular weight 434.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzyl-2-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-5-methyl-1H-pyrazol-3-one
Also Known As: 4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol, 4-benzyl-2-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-5-methyl-1H-pyrazol-3-one
| Molecular Formula | C20H15BrN6O |
|---|---|
| Molecular Weight | 434.05 g/mol |
| LogP | 3.64682 |
| Topological Polar Surface Area | 92.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 434.04907 |
| Heavy Atoms | 28 |
| Complexity | 1382.8883 |
Chemical Identifiers
| CAS Number | 371228-69-2 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C2=NC3=C(C4=C(N3)C=CC(=C4)Br)N=N2)CC5=CC=CC=C5 |
Product Overview
4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol (CAS 371228-69-2), with molecular formula C20H15BrN6O and molecular weight 434.05 g/mol. IUPAC: 4-benzyl-2-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-5-methyl-1H-pyrazol-3-one.
Chemical Property Profile of 4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol
Property Insights of 4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol
The XLogP value of 3.64682 indicates that 4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.25 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol. Following Lipinski's Rule of Five, 4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol has 2 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-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol?
The CAS number of 4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol is 371228-69-2.
What is the molecular formula of 4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol?
The molecular formula of 4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol is C20H15BrN6O.
What is the molecular weight of 4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol?
The molecular weight of 4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol is 434.05 g/mol.
Where can I buy 4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol?
You can request a quote for 4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol?
Yes, KEHONG BIO provides custom synthesis services for 4-benzyl-1-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)-3-methyl-1H-pyrazol-5-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.