5-Phenyl-3-thioureido-1,2,4-thiadiazole
TL;DR: 5-Phenyl-3-thioureido-1,2,4-thiadiazole (CAS 97149-60-5) is a chemical compound with molecular formula C9H8N4S2 and molecular weight 236.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-phenyl-1,2,4-thiadiazol-3-yl)thiourea
Also Known As: 5-phenyl-3-thioureido-1,2,4-thiadiazole, Thiourea, (5-phenyl-1,2,4-thiadiazol-3-yl)-, (5-phenyl-1,2,4-thiadiazol-3-yl)thiourea, J1.676.733F, N-(5-Phenyl-1,2,4-thiadiazol-3-yl)thiourea
| Molecular Formula | C9H8N4S2 |
|---|---|
| Molecular Weight | 236.02 g/mol |
| LogP | 1.8606 |
| Topological Polar Surface Area | 63.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.01904 |
| Heavy Atoms | 15 |
| Complexity | 465.9744 |
Chemical Identifiers
| CAS Number | 97149-60-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=NS2)NC(=S)N |
Product Overview
5-Phenyl-3-thioureido-1,2,4-thiadiazole (CAS 97149-60-5), with molecular formula C9H8N4S2 and molecular weight 236.02 g/mol. IUPAC: (5-phenyl-1,2,4-thiadiazol-3-yl)thiourea.
Chemical Property Profile of 5-Phenyl-3-thioureido-1,2,4-thiadiazole
Property Insights of 5-Phenyl-3-thioureido-1,2,4-thiadiazole
The XLogP value of 1.8606 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Phenyl-3-thioureido-1,2,4-thiadiazole. The TPSA of 63.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Phenyl-3-thioureido-1,2,4-thiadiazole. Following Lipinski's Rule of Five, 5-Phenyl-3-thioureido-1,2,4-thiadiazole has 2 hydrogen bond donor(s) and 4 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 5-Phenyl-3-thioureido-1,2,4-thiadiazole?
The CAS number of 5-Phenyl-3-thioureido-1,2,4-thiadiazole is 97149-60-5.
What is the molecular formula of 5-Phenyl-3-thioureido-1,2,4-thiadiazole?
The molecular formula of 5-Phenyl-3-thioureido-1,2,4-thiadiazole is C9H8N4S2.
What is the molecular weight of 5-Phenyl-3-thioureido-1,2,4-thiadiazole?
The molecular weight of 5-Phenyl-3-thioureido-1,2,4-thiadiazole is 236.02 g/mol.
Where can I buy 5-Phenyl-3-thioureido-1,2,4-thiadiazole?
You can request a quote for 5-Phenyl-3-thioureido-1,2,4-thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Phenyl-3-thioureido-1,2,4-thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Phenyl-3-thioureido-1,2,4-thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.