![1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea structure](/static/products/4262/426237-58-3.webp)
1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea
TL;DR: 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea (CAS 426237-58-3) is a chemical compound with molecular formula C19H20N4O2S2 and molecular weight 400.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-(benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea
Also Known As: AB00106326-01, 1-[5-(benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea, 1-(5-((benzylthio)methyl)-1,3,4-thiadiazol-2-yl)-3-(4-ethoxyphenyl)urea, 1-[(2E)-5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-(4-ethoxyphenyl)urea
| Molecular Formula | C19H20N4O2S2 |
|---|---|
| Molecular Weight | 400.10 g/mol |
| LogP | 5.0142 |
| Topological Polar Surface Area | 76.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 400.10278 |
| Heavy Atoms | 27 |
| Complexity | 853.6609 |
Chemical Identifiers
| CAS Number | 426237-58-3 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)CSCC3=CC=CC=C3 |
Product Overview
1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea (CAS 426237-58-3), with molecular formula C19H20N4O2S2 and molecular weight 400.10 g/mol. IUPAC: 1-[5-(benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea.
Chemical Property Profile of 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea
Property Insights of 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea
The XLogP value of 5.0142 indicates that 1-[5-(Benzylsulfanylmethyl)-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 76.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea. Following Lipinski's Rule of Five, 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea?
The CAS number of 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea is 426237-58-3.
What is the molecular formula of 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea?
The molecular formula of 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea is C19H20N4O2S2.
What is the molecular weight of 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea?
The molecular weight of 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea is 400.10 g/mol.
Where can I buy 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea?
You can request a quote for 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.