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C28H28FN3O4S structure
Fine Chemical

C28H28FN3O4S

TL;DR: C28H28FN3O4S (CAS 1031764-95-0) is a chemical compound with molecular formula C28H28FN3O4S and molecular weight 521.17847 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-(3-ethoxyphenyl)-2-[3-[2-(4-fluorophenyl)ethyl]-1-(4-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetamide

Also Known As: N-(3-ethoxyphenyl)-2-{3-[2-(4-fluorophenyl)ethyl]-1-(4-methoxyphenyl)-5-oxo-2-thioxoimidazolidin-4-yl}acetamide, N-(3-ethoxyphenyl)-2-(3-(4-fluorophenethyl)-1-(4-methoxyphenyl)-5-oxo-2-thioxoimidazolidin-4-yl)acetamide, N-(3-ethoxyphenyl)-2-[3-[2-(4-fluorophenyl)ethyl]-1-(4-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetamide, N-(3-ETHOXYPHENYL)-2-{3-[2-(4-FLUOROPHENYL)ETHYL]-1-(4-METHOXYPHENYL)-5-OXO-2-SULFANYLIDENEIMIDAZOLIDIN-4-YL}ACETAMIDE, C28H28FN3O4S

CAS Number
1031764-95-0
Molecular Formula
C28H28FN3O4S
Molecular Weight
521.17847 g/mol
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Technical Specifications

Molecular FormulaC28H28FN3O4S
Molecular Weight521.17847 g/mol
XLogP4.7
Topological Polar Surface Area (TPSA)103.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds10
Exact Mass521.17847 Da
Heavy Atoms37
Complexity785.0
SMILESCCOC1=CC=CC(=C1)NC(=O)CC2C(=O)N(C(=S)N2CCC3=CC=C(C=C3)F)C4=CC=C(C=C4)OC
InChIKeyJKLDGINAXHKNAC-UHFFFAOYSA-N

Chemical Property Profile of C28H28FN3O4S

XLogP
4.7
TPSA (Topological Polar Surface Area)
103.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
10
Heavy Atoms
37
Complexity
785.0
Exact Mass
521.17847
Monoisotopic Mass
521.17847
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 C28H28FN3O4S

The XLogP value of 4.7 indicates that C28H28FN3O4S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C28H28FN3O4S. Following Lipinski's Rule of Five, C28H28FN3O4S has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of C28H28FN3O4S?

The CAS number of C28H28FN3O4S is 1031764-95-0.

What is the molecular formula of C28H28FN3O4S?

The molecular formula of C28H28FN3O4S is C28H28FN3O4S.

What is the molecular weight of C28H28FN3O4S?

The molecular weight of C28H28FN3O4S is 521.17847 g/mol.

Where can I buy C28H28FN3O4S?

You can request a quote for C28H28FN3O4S directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for C28H28FN3O4S?

Yes, CoreyChem provides custom synthesis services for C28H28FN3O4S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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