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1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea structure
Fine Chemical

1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea

TL;DR: 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea (CAS 428478-31-3) is a chemical compound with molecular formula C20H22N4O3S and molecular weight 398.14127 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-[5-[(2,4-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea

Also Known As: 1-[5-[(2,4-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea, 1-(5-((2,4-dimethylphenoxy)methyl)-1,3,4-thiadiazol-2-yl)-3-(4-ethoxyphenyl)urea, 1-[(2Z)-5-[(2,4-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-(4-ethoxyphenyl)urea

CAS Number
428478-31-3
Molecular Formula
C20H22N4O3S
Molecular Weight
398.14127 g/mol
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Technical Specifications

Molecular FormulaC20H22N4O3S
Molecular Weight398.14127 g/mol
XLogP3.8
Topological Polar Surface Area (TPSA)114.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors6
Rotatable Bonds7
Exact Mass398.14127 Da
Heavy Atoms28
Complexity490.0
SMILESCCOC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)COC3=C(C=C(C=C3)C)C
InChIKeyMEAJOGMIHBMKFC-UHFFFAOYSA-N

Product Description

Applications: 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea (CAS 428478-31-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea is a fine chemical identified by CAS number 428478-31-3 and the molecular formula C20H22N4O3S and a molecular weight of 398.14 g/mol. It is also known as 1-[5-[(2,4-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea and 1-(5-((2,4-dimethylphenoxy)methyl)-1,3,4-thiadiazol-2-yl)-3-(4-ethoxyphenyl)urea.

CoreyChem provides it with COA documentation, and custom synthesis from milligram to multi-kilogram scales is available on request. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea

XLogP
3.8
TPSA (Topological Polar Surface Area)
114.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
7
Heavy Atoms
28
Complexity
490.0
Exact Mass
398.14127
Monoisotopic Mass
398.14127
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 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea

The XLogP value of 3.8 indicates that 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea. Following Lipinski's Rule of Five, 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea?

The CAS number of 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea is 428478-31-3.

What is the molecular formula of 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea?

The molecular formula of 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea is C20H22N4O3S.

What is the molecular weight of 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea?

The molecular weight of 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea is 398.14127 g/mol.

What are the applications of 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea?

1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...

Where can I buy 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea?

You can request a quote for 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea?

Yes, CoreyChem provides custom synthesis services for 1-[5-[(2,4-Dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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