![(2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide structure](/static/products/100/1008579-93-8.webp)
(2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide
TL;DR: (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide (CAS 1008579-93-8) is a chemical compound with molecular formula C25H25N5O5S2 and molecular weight 539.1297 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-2-cyano-3-[3-[3-(dimethylsulfamoyl)phenyl]-1-phenylpyrazol-4-yl]-N-(1,1-dioxothiolan-3-yl)prop-2-enamide
Also Known As: (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide, (E)-2-cyano-3-(3-(3-(N,N-dimethylsulfamoyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acrylamide, (E)-2-cyano-3-[3-[3-(dimethylsulfamoyl)phenyl]-1-phenylpyrazol-4-yl]-N-(1,1-dioxothiolan-3-yl)prop-2-enamide
Technical Specifications
| Molecular Formula | C25H25N5O5S2 |
| Molecular Weight | 539.1297 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 159.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 539.1297 Da |
| Heavy Atoms | 37 |
| Complexity | 1130.0 |
| SMILES | CN(C)S(=O)(=O)C1=CC=CC(=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NC3CCS(=O)(=O)C3)C4=CC=CC=C4 |
| InChIKey | RQRZZJDAVHTRCV-CPNJWEJPSA-N |
Chemical Property Profile of (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide
Property Insights of (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide. The TPSA of 159.0 Ų indicates high polarity, suggesting (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide?
The CAS number of (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide is 1008579-93-8.
What is the molecular formula of (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide?
The molecular formula of (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide is C25H25N5O5S2.
What is the molecular weight of (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide?
The molecular weight of (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide is 539.1297 g/mol.
Where can I buy (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide?
You can request a quote for (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide?
Yes, CoreyChem provides custom synthesis services for (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.