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(2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide structure
Fine Chemical

(2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide

TL;DR: (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide (CAS 1009191-23-4) is a chemical compound with molecular formula C27H27N7O3S and molecular weight 529.18964 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-(3-imidazol-1-ylpropyl)prop-2-enamide

Also Known As: (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide, (E)-2-cyano-3-[3-[3-(dimethylsulfamoyl)phenyl]-1-phenylpyrazol-4-yl]-N-(3-imidazol-1-ylpropyl)prop-2-enamide, (E)-N-(3-(1H-imidazol-1-yl)propyl)-2-cyano-3-(3-(3-(N,N-dimethylsulfamoyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylamide

CAS Number
1009191-23-4
Molecular Formula
C27H27N7O3S
Molecular Weight
529.18964 g/mol
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Technical Specifications

Molecular FormulaC27H27N7O3S
Molecular Weight529.18964 g/mol
XLogP2.4
Topological Polar Surface Area (TPSA)134.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors7
Rotatable Bonds10
Exact Mass529.18964 Da
Heavy Atoms38
Complexity980.0
SMILESCN(C)S(=O)(=O)C1=CC=CC(=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NCCCN3C=CN=C3)C4=CC=CC=C4
InChIKeyYUWXXQNCCFMQDR-CJLVFECKSA-N

Product Description

Applications: AC1O00I3 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies AC1O00I3 (CAS 1009191-23-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

AC1O00I3 is a fine chemical identified by CAS number 1009191-23-4 and the molecular formula C27H27N7O3S and a molecular weight of 529.19 g/mol. It is also known as (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide and (E)-2-cyano-3-[3-[3-(dimethylsulfamoyl)phenyl]-1-phenylpyrazol-4-yl]-N-(3-imidazol-1-ylpropyl)prop-2-enamide.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide

XLogP
2.4
TPSA (Topological Polar Surface Area)
134.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
7
Rotatable Bonds
10
Heavy Atoms
38
Complexity
980.0
Exact Mass
529.18964
Monoisotopic Mass
529.18964
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide

The XLogP value of 2.4 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-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide. Following Lipinski's Rule of Five, (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide has 1 hydrogen bond donor(s) and 7 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-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide?

The CAS number of (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide is 1009191-23-4.

What is the molecular formula of (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide?

The molecular formula of (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide is C27H27N7O3S.

What is the molecular weight of (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide?

The molecular weight of (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide is 529.18964 g/mol.

What are the applications of (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide?

AC1O00I3 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies AC1O00I3 (CAS 1009191-23-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS...

Where can I buy (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide?

You can request a quote for (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]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-[3-(1H-imidazol-1-yl)propyl]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-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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