(E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one
TL;DR: (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one (CAS 956411-74-8) is a chemical compound with molecular formula C26H28N4O3S and molecular weight 476.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one
Also Known As: (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one, 3-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]prop-2-en-1-one
| Molecular Formula | C26H28N4O3S |
|---|---|
| Molecular Weight | 476.19 g/mol |
| LogP | 3.64724 |
| Topological Polar Surface Area | 75.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 476.1882 |
| Heavy Atoms | 34 |
| Complexity | 1304.8353 |
Chemical Identifiers
| CAS Number | 956411-74-8 |
|---|---|
| SMILES | CC1=C(C(=NN1C2=CC=CC=C2)C)/C=C/C(=O)N3CCN(CC3)S(=O)(=O)/C=C/C4=CC=CC=C4 |
Product Overview
(E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one (CAS 956411-74-8), with molecular formula C26H28N4O3S and molecular weight 476.19 g/mol. IUPAC: (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one.
Chemical Property Profile of (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one
Property Insights of (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one
The XLogP value of 3.64724 indicates that (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.51 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one. Following Lipinski's Rule of Five, (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one has 0 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 (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one?
The CAS number of (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one is 956411-74-8.
What is the molecular formula of (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one?
The molecular formula of (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one is C26H28N4O3S.
What is the molecular weight of (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one?
The molecular weight of (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one is 476.19 g/mol.
Where can I buy (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one?
You can request a quote for (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.