![5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine structure](/static/products/1127/112764-29-1.webp)
5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine
TL;DR: 5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine (CAS 112764-29-1) is a chemical compound with molecular formula C9H9N3S2 and molecular weight 223.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-methylsulfanylphenyl)-1,3,4-thiadiazol-2-amine
Also Known As: 5-[2-(methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine, 5-(2-methylsulfanylphenyl)-1,3,4-thiadiazol-2-amine, 1,3,4-Thiadiazol-2-amine, 5-[2-(methylthio)phenyl]-, 5-(2-(methylthio)phenyl)-1,3,4-thiadiazol-2-amine, 5-[2-(Methylthio)phenyl]-1,3,4-thiadiazol-2-amine
| Molecular Formula | C9H9N3S2 |
|---|---|
| Molecular Weight | 223.02 g/mol |
| LogP | 2.5092 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.02379 |
| Heavy Atoms | 14 |
| Complexity | 439.12704 |
Chemical Identifiers
| CAS Number | 112764-29-1 |
|---|---|
| SMILES | CSC1=CC=CC=C1C2=NN=C(S2)N |
Product Overview
5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine (CAS 112764-29-1), with molecular formula C9H9N3S2 and molecular weight 223.02 g/mol. IUPAC: 5-(2-methylsulfanylphenyl)-1,3,4-thiadiazol-2-amine.
Chemical Property Profile of 5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine
Property Insights of 5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine
The XLogP value of 2.5092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine. With a topological polar surface area (TPSA) of 51.8 Ų, 5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine has 1 hydrogen bond donor(s) and 5 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-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine?
The CAS number of 5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine is 112764-29-1.
What is the molecular formula of 5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine?
The molecular formula of 5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine is C9H9N3S2.
What is the molecular weight of 5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine?
The molecular weight of 5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine is 223.02 g/mol.
Where can I buy 5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine?
You can request a quote for 5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine?
Yes, KEHONG BIO provides custom synthesis services for 5-[2-(Methylsulfanyl)phenyl]-1,3,4-thiadiazol-2-ylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.