1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)-
TL;DR: 1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)- (CAS 78613-13-5) is a chemical compound with molecular formula C17H16N2O2S and molecular weight 312.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(4-methoxyphenyl)-1-phenylethyl]-3H-1,3,4-oxadiazole-2-thione
Also Known As: 5-(p-Methoxy-alpha-phenylphenethyl)-1,3,4-oxadiazole-2-thiol, 1,3,4-OXADIAZOLE-2-THIOL, 5-(p-METHOXY-alpha-PHENYLPHENETHYL)-, 5-[2-(4-Methoxyphenyl)-1-phenylethyl]-1,3,4-oxadiazole-2-thiol, 5-[2-(4-methoxyphenyl)-1-phenylethyl]-3H-1,3,4-oxadiazole-2-thione, RefChem:216997
| Molecular Formula | C17H16N2O2S |
|---|---|
| Molecular Weight | 312.09 g/mol |
| LogP | 4.11539 |
| Topological Polar Surface Area | 51.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.09326 |
| Heavy Atoms | 22 |
| Complexity | 778.17847 |
Chemical Identifiers
| CAS Number | 78613-13-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CC(C2=CC=CC=C2)C3=NNC(=S)O3 |
Product Overview
1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)- (CAS 78613-13-5), with molecular formula C17H16N2O2S and molecular weight 312.09 g/mol. IUPAC: 5-[2-(4-methoxyphenyl)-1-phenylethyl]-3H-1,3,4-oxadiazole-2-thione.
Chemical Property Profile of 1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)-
Property Insights of 1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)-
The XLogP value of 4.11539 indicates that 1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.05 Ų, 1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)- has 1 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 1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)-?
The CAS number of 1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)- is 78613-13-5.
What is the molecular formula of 1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)-?
The molecular formula of 1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)- is C17H16N2O2S.
What is the molecular weight of 1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)-?
The molecular weight of 1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)- is 312.09 g/mol.
Where can I buy 1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)-?
You can request a quote for 1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4-Oxadiazole-2-thiol, 5-(p-methoxy-alpha-phenylphenethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.