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ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate structure
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ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate

TL;DR: ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate (CAS 1022919-64-7) is a chemical compound with molecular formula C26H29FN4O5S and molecular weight 528.18427 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate

Also Known As: ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate, ethyl 4-(4-{2-[(4-fluorophenyl)amino]-2-oxoethyl}-3-[2-(morpholin-4-yl)ethyl]-5-oxo-2-thioxoimidazolidin-1-yl)benzoate, ethyl 4-(4-(2-((4-fluorophenyl)amino)-2-oxoethyl)-3-(2-morpholinoethyl)-5-oxo-2-thioxoimidazolidin-1-yl)benzoate, ETHYL 4-[4-[2-(4-FLUOROANILINO)-2-OXOETHYL]-3-(2-MORPHOLINOETHYL)-5-OXO-2-THIOXO-1-IMIDAZOLIDINYL]BENZOATE, C26H29FN4O5S

CAS Number
1022919-64-7
Molecular Formula
C26H29FN4O5S
Molecular Weight
528.18427 g/mol
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Technical Specifications

Molecular FormulaC26H29FN4O5S
Molecular Weight528.18427 g/mol
XLogP2.3
Topological Polar Surface Area (TPSA)124.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors8
Rotatable Bonds10
Exact Mass528.18427 Da
Heavy Atoms37
Complexity826.0
SMILESCCOC(=O)C1=CC=C(C=C1)N2C(=O)C(N(C2=S)CCN3CCOCC3)CC(=O)NC4=CC=C(C=C4)F
InChIKeyGNRARTGRMAJGMM-UHFFFAOYSA-N

Chemical Property Profile of ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate

XLogP
2.3
TPSA (Topological Polar Surface Area)
124.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
8
Rotatable Bonds
10
Heavy Atoms
37
Complexity
826.0
Exact Mass
528.18427
Monoisotopic Mass
528.18427
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 ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate

The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate. Following Lipinski's Rule of Five, ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate 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 ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate?

The CAS number of ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate is 1022919-64-7.

What is the molecular formula of ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate?

The molecular formula of ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate is C26H29FN4O5S.

What is the molecular weight of ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate?

The molecular weight of ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate is 528.18427 g/mol.

Where can I buy ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate?

You can request a quote for ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate?

Yes, CoreyChem provides custom synthesis services for ethyl 4-[4-[2-(4-fluoroanilino)-2-oxoethyl]-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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