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2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone structure
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2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone

TL;DR: 2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone (CAS 1241685-05-1) is a chemical compound with molecular formula C20H29N3O3S and molecular weight 391.19296 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone

Also Known As: 2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone, 2-(azepan-1-yl)-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one

CAS Number
1241685-05-1
Molecular Formula
C20H29N3O3S
Molecular Weight
391.19296 g/mol
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Technical Specifications

Molecular FormulaC20H29N3O3S
Molecular Weight391.19296 g/mol
XLogP2.0
Topological Polar Surface Area (TPSA)69.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors5
Rotatable Bonds5
Exact Mass391.19296 Da
Heavy Atoms27
Complexity592.0
SMILESC1CCCN(CC1)CC(=O)N2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3
InChIKeyWGFOOLALWRSMMS-LICLKQGHSA-N

Chemical Property Profile of 2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone

XLogP
2.0
TPSA (Topological Polar Surface Area)
69.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
5
Heavy Atoms
27
Complexity
592.0
Exact Mass
391.19296
Monoisotopic Mass
391.19296
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 2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone

The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone. The TPSA of 69.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone. Following Lipinski's Rule of Five, 2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone?

The CAS number of 2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone is 1241685-05-1.

What is the molecular formula of 2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone?

The molecular formula of 2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone is C20H29N3O3S.

What is the molecular weight of 2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone?

The molecular weight of 2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone is 391.19296 g/mol.

Where can I buy 2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone?

You can request a quote for 2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone?

Yes, CoreyChem provides custom synthesis services for 2-(azepan-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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