![3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one structure](/static/products/851/851622-99-6.png)
3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one
TL;DR: 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one (CAS 851622-99-6) is a chemical compound with molecular formula C20H21N5O3S and molecular weight 411.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one
Also Known As: 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one, 3-{[4-(2-phenylethenesulfonyl)piperazin-1-yl]methyl}-3,4-dihydro-1,2,3-benzotriazin-4-one
| Molecular Formula | C20H21N5O3S |
|---|---|
| Molecular Weight | 411.14 g/mol |
| LogP | 1.3673 |
| Topological Polar Surface Area | 88.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.1365 |
| Heavy Atoms | 29 |
| Complexity | 1183.4672 |
Chemical Identifiers
| CAS Number | 851622-99-6 |
|---|---|
| SMILES | C1CN(CCN1CN2C(=O)C3=CC=CC=C3N=N2)S(=O)(=O)/C=C/C4=CC=CC=C4 |
Product Overview
3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one (CAS 851622-99-6), with molecular formula C20H21N5O3S and molecular weight 411.14 g/mol. IUPAC: 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one.
Chemical Property Profile of 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one
Property Insights of 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one
The XLogP value of 1.3673 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one. The TPSA of 88.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one. Following Lipinski's Rule of Five, 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one has 0 hydrogen bond donor(s) and 6 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 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one?
The CAS number of 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one is 851622-99-6.
What is the molecular formula of 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one?
The molecular formula of 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one is C20H21N5O3S.
What is the molecular weight of 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one?
The molecular weight of 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one is 411.14 g/mol.
Where can I buy 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one?
You can request a quote for 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.