Bionet1_000852
TL;DR: Bionet1_000852 (CAS 338751-65-8) is a chemical compound with molecular formula C21H18N4OS and molecular weight 374.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(4-methoxyphenyl)-2-(3-phenylprop-2-enylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine
Also Known As: Bionet1_000852, 7-(4-methoxyphenyl)-2-(3-phenylprop-2-enylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine, 7-(4-methoxyphenyl)-2-[(3-phenyl-2-propenyl)sulfanyl][1,2,4]triazolo[1,5-a]pyrimidine, 7-(4-methoxyphenyl)-2-[(3-phenylprop-2-en-1-yl)sulfanyl]-[1,2,4]triazolo[1,5-a]pyrimidine
| Molecular Formula | C21H18N4OS |
|---|---|
| Molecular Weight | 374.12 g/mol |
| LogP | 4.6054 |
| Topological Polar Surface Area | 52.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 374.12012 |
| Heavy Atoms | 27 |
| Complexity | 1058.6965 |
Chemical Identifiers
| CAS Number | 338751-65-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=CC=NC3=NC(=NN23)SCC=CC4=CC=CC=C4 |
Product Overview
Bionet1_000852 (CAS 338751-65-8), with molecular formula C21H18N4OS and molecular weight 374.12 g/mol. IUPAC: 7-(4-methoxyphenyl)-2-(3-phenylprop-2-enylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine.
Chemical Property Profile of Bionet1_000852
Property Insights of Bionet1_000852
The XLogP value of 4.6054 indicates that Bionet1_000852 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.31 Ų, Bionet1_000852 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_000852 has 0 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 Bionet1_000852?
The CAS number of Bionet1_000852 is 338751-65-8.
What is the molecular formula of Bionet1_000852?
The molecular formula of Bionet1_000852 is C21H18N4OS.
What is the molecular weight of Bionet1_000852?
The molecular weight of Bionet1_000852 is 374.12 g/mol.
Where can I buy Bionet1_000852?
You can request a quote for Bionet1_000852 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_000852?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_000852 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.