5-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole
TL;DR: 5-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole (CAS 338408-21-2) is a chemical compound with molecular formula C11H12N2S2 and molecular weight 236.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-phenyl-5-propan-2-ylsulfanylthiadiazole
Also Known As: 5-(isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole, 4-phenyl-5-propan-2-ylsulfanylthiadiazole, 5-(isopropylthio)-4-phenyl-thiadiazole, 5-isopropylsulfanyl-4-phenyl-thiadiazole, 4-phenyl-5-(propan-2-ylthio)thiadiazole
| Molecular Formula | C11H12N2S2 |
|---|---|
| Molecular Weight | 236.04 g/mol |
| LogP | 3.7056 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.04419 |
| Heavy Atoms | 15 |
| Complexity | 423.16278 |
Chemical Identifiers
| CAS Number | 338408-21-2 |
|---|---|
| SMILES | CC(C)SC1=C(N=NS1)C2=CC=CC=C2 |
Product Overview
5-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole (CAS 338408-21-2), with molecular formula C11H12N2S2 and molecular weight 236.04 g/mol. IUPAC: 4-phenyl-5-propan-2-ylsulfanylthiadiazole.
Chemical Property Profile of 5-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole
Property Insights of 5-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole
The XLogP value of 3.7056 indicates that 5-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.78 Ų, 5-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole has 0 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-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole?
The CAS number of 5-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole is 338408-21-2.
What is the molecular formula of 5-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole?
The molecular formula of 5-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole is C11H12N2S2.
What is the molecular weight of 5-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole?
The molecular weight of 5-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole is 236.04 g/mol.
Where can I buy 5-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole?
You can request a quote for 5-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(Isopropylsulfanyl)-4-phenyl-1,2,3-thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.