![2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole structure](/static/products/6729/672950-61-7.webp)
2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole
TL;DR: 2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole (CAS 672950-61-7) is a chemical compound with molecular formula C18H16N2OS and molecular weight 308.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole
Also Known As: 2-[(3-methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole, 3-methylbenzyl 5-[(E)-2-phenylethenyl]-1,3,4-oxadiazol-2-yl sulfide
| Molecular Formula | C18H16N2OS |
|---|---|
| Molecular Weight | 308.10 g/mol |
| LogP | 4.84072 |
| Topological Polar Surface Area | 38.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.09833 |
| Heavy Atoms | 22 |
| Complexity | 765.523 |
Chemical Identifiers
| CAS Number | 672950-61-7 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CSC2=NN=C(O2)C=CC3=CC=CC=C3 |
Product Overview
2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole (CAS 672950-61-7), with molecular formula C18H16N2OS and molecular weight 308.10 g/mol. IUPAC: 2-[(3-methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole.
Chemical Property Profile of 2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole
Property Insights of 2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole
The XLogP value of 4.84072 indicates that 2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.92 Ų, 2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole 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 2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole?
The CAS number of 2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole is 672950-61-7.
What is the molecular formula of 2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole?
The molecular formula of 2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole is C18H16N2OS.
What is the molecular weight of 2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole?
The molecular weight of 2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole is 308.10 g/mol.
Where can I buy 2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole?
You can request a quote for 2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-Methylphenyl)methylsulfanyl]-5-(2-phenylethenyl)-1,3,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.