(E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide
TL;DR: (E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide (CAS 381207-07-4) is a chemical compound with molecular formula C20H18N4O3S and molecular weight 394.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(E)-3-(4-methylphenyl)-3-oxoprop-1-enyl]amino]-N-pyrimidin-2-ylbenzenesulfonamide
Also Known As: (E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide, 4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}-N-(pyrimidin-2-yl)benzenesulfonamide, 4-[[(E)-3-(4-methylphenyl)-3-oxoprop-1-enyl]amino]-N-pyrimidin-2-ylbenzenesulfonamide
| Molecular Formula | C20H18N4O3S |
|---|---|
| Molecular Weight | 394.11 g/mol |
| LogP | 3.39432 |
| Topological Polar Surface Area | 101.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 394.10995 |
| Heavy Atoms | 28 |
| Complexity | 1078.5594 |
Chemical Identifiers
| CAS Number | 381207-07-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)/C=C/NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3 |
Product Overview
(E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide (CAS 381207-07-4), with molecular formula C20H18N4O3S and molecular weight 394.11 g/mol. IUPAC: 4-[[(E)-3-(4-methylphenyl)-3-oxoprop-1-enyl]amino]-N-pyrimidin-2-ylbenzenesulfonamide.
Chemical Property Profile of (E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide
Property Insights of (E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide
The XLogP value of 3.39432 indicates that (E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.05 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide. Following Lipinski's Rule of Five, (E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide has 2 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 (E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide?
The CAS number of (E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide is 381207-07-4.
What is the molecular formula of (E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide?
The molecular formula of (E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide is C20H18N4O3S.
What is the molecular weight of (E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide?
The molecular weight of (E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide is 394.11 g/mol.
Where can I buy (E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide?
You can request a quote for (E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)-N-(pyrimidin-2-yl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.