1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea
TL;DR: 1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea (CAS 898462-67-4) is a chemical compound with molecular formula C17H14N4O2S2 and molecular weight 370.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea
Also Known As: 1-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea, 3-{5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1-phenylurea, F2680-1036, 1-(5-((2-oxo-2-phenylethyl)thio)-1,3,4-thiadiazol-2-yl)-3-phenylurea
| Molecular Formula | C17H14N4O2S2 |
|---|---|
| Molecular Weight | 370.06 g/mol |
| LogP | 4.1571 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 370.05582 |
| Heavy Atoms | 25 |
| Complexity | 853.354 |
Chemical Identifiers
| CAS Number | 898462-67-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)NC(=O)NC3=CC=CC=C3 |
Product Overview
1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea (CAS 898462-67-4), with molecular formula C17H14N4O2S2 and molecular weight 370.06 g/mol. IUPAC: 1-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea.
Chemical Property Profile of 1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea
Property Insights of 1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea
The XLogP value of 4.1571 indicates that 1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea. Following Lipinski's Rule of Five, 1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea 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
Frequently Asked Questions
What is the CAS number of 1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea?
The CAS number of 1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea is 898462-67-4.
What is the molecular formula of 1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea?
The molecular formula of 1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea is C17H14N4O2S2.
What is the molecular weight of 1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea?
The molecular weight of 1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea is 370.06 g/mol.
Where can I buy 1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea?
You can request a quote for 1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-3-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.