1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea
TL;DR: 1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea (CAS 428481-84-9) is a chemical compound with molecular formula C26H26N4O3S and molecular weight 474.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methoxyphenyl)-3-[5-[[4-(2-phenylpropan-2-yl)phenoxy]methyl]-1,3,4-thiadiazol-2-yl]urea
Also Known As: 1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea, 1-(2-methoxyphenyl)-3-[(2Z)-5-{[4-(2-phenylpropan-2-yl)phenoxy]methyl}-1,3,4-thiadiazol-2(3H)-ylidene]urea, 1-(2-methoxyphenyl)-3-[5-[[4-(2-phenylpropan-2-yl)phenoxy]methyl]-1,3,4-thiadiazol-2-yl]urea, 3-(2-methoxyphenyl)-1-[5-[[4-(2-phenylpropan-2-yl)phenoxy]methyl]-1,3,4-thiadiazol-2-yl]urea, N-(2-methoxyphenyl)-N'-(5-{[4-(1-methyl-1-phenylethyl)phenoxy]methyl}-1,3,4-thiadiazol-2-yl)urea
| Molecular Formula | C26H26N4O3S |
|---|---|
| Molecular Weight | 474.17 g/mol |
| LogP | 6.0956 |
| Topological Polar Surface Area | 85.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 474.17258 |
| Heavy Atoms | 34 |
| Complexity | 1240.4125 |
Chemical Identifiers
| CAS Number | 428481-84-9 |
|---|---|
| SMILES | CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCC3=NN=C(S3)NC(=O)NC4=CC=CC=C4OC |
Product Overview
1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea (CAS 428481-84-9), with molecular formula C26H26N4O3S and molecular weight 474.17 g/mol. IUPAC: 1-(2-methoxyphenyl)-3-[5-[[4-(2-phenylpropan-2-yl)phenoxy]methyl]-1,3,4-thiadiazol-2-yl]urea.
Chemical Property Profile of 1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea
Property Insights of 1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea
The XLogP value of 6.0956 indicates that 1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.37 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea. Following Lipinski's Rule of Five, 1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)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-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea?
The CAS number of 1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea is 428481-84-9.
What is the molecular formula of 1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea?
The molecular formula of 1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea is C26H26N4O3S.
What is the molecular weight of 1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea?
The molecular weight of 1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea is 474.17 g/mol.
Where can I buy 1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea?
You can request a quote for 1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-methoxyphenyl)-3-(5-((4-(2-phenylpropan-2-yl)phenoxy)methyl)-1,3,4-thiadiazol-2-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.