5-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-2-ylamine
TL;DR: 5-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-2-ylamine (CAS 301352-68-1) is a chemical compound with molecular formula C15H13N3S2 and molecular weight 299.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-phenylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine
Also Known As: 5-[(4-phenylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine, 5-[(4-phenylphenyl)methylthio]-1,3,4-thiadiazole-2-ylamine, 5-[(biphenyl-4-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-amine, 5-(([1,1'-biphenyl]-4-ylmethyl)thio)-1,3,4-thiadiazol-2-amine, 5-[([1,1'-biphenyl]-4-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-amine
| Molecular Formula | C15H13N3S2 |
|---|---|
| Molecular Weight | 299.06 g/mol |
| LogP | 4.0796 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.05508 |
| Heavy Atoms | 20 |
| Complexity | 677.8531 |
Chemical Identifiers
| CAS Number | 301352-68-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)CSC3=NN=C(S3)N |
Product Overview
5-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-2-ylamine (CAS 301352-68-1), with molecular formula C15H13N3S2 and molecular weight 299.06 g/mol. IUPAC: 5-[(4-phenylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine.
Chemical Property Profile of 5-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-2-ylamine
Property Insights of 5-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-2-ylamine
The XLogP value of 4.0796 indicates that 5-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-2-ylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 5-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-2-ylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-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-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-2-ylamine?
The CAS number of 5-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-2-ylamine is 301352-68-1.
What is the molecular formula of 5-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-2-ylamine?
The molecular formula of 5-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-2-ylamine is C15H13N3S2.
What is the molecular weight of 5-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-2-ylamine?
The molecular weight of 5-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-2-ylamine is 299.06 g/mol.
Where can I buy 5-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-2-ylamine?
You can request a quote for 5-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-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-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-2-ylamine?
Yes, KEHONG BIO provides custom synthesis services for 5-[(4-Phenylphenyl)methylthio]-1,3,4-thiadiazole-2-ylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.