Bionet1_002272
TL;DR: Bionet1_002272 (CAS 478042-93-2) is a chemical compound with molecular formula C20H15ClN2OS and molecular weight 366.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-6-(4-chlorophenyl)-4-methylsulfanyl-2-oxopyridine-3-carbonitrile
Also Known As: Bionet1_002272, 1-benzyl-6-(4-chlorophenyl)-4-(methylsulfanyl)-2-oxo-1,2-dihydro-3-pyridinecarbonitrile, 1-benzyl-6-(4-chlorophenyl)-4-(methylsulfanyl)-2-oxo-1,2-dihydropyridine-3-carbonitrile, 1-benzyl-6-(4-chlorophenyl)-4-methylsulfanyl-2-oxopyridine-3-carbonitrile, 1-benzyl-6-(4-chlorophenyl)-2-keto-4-(methylthio)nicotinonitrile
| Molecular Formula | C20H15ClN2OS |
|---|---|
| Molecular Weight | 366.06 g/mol |
| LogP | 4.81058 |
| Topological Polar Surface Area | 45.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 366.05936 |
| Heavy Atoms | 25 |
| Complexity | 989.1901 |
Chemical Identifiers
| CAS Number | 478042-93-2 |
|---|---|
| SMILES | CSC1=C(C(=O)N(C(=C1)C2=CC=C(C=C2)Cl)CC3=CC=CC=C3)C#N |
Product Overview
Bionet1_002272 (CAS 478042-93-2), with molecular formula C20H15ClN2OS and molecular weight 366.06 g/mol. IUPAC: 1-benzyl-6-(4-chlorophenyl)-4-methylsulfanyl-2-oxopyridine-3-carbonitrile.
Chemical Property Profile of Bionet1_002272
Property Insights of Bionet1_002272
The XLogP value of 4.81058 indicates that Bionet1_002272 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.79 Ų, Bionet1_002272 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_002272 has 0 hydrogen bond donor(s) and 3 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_002272?
The CAS number of Bionet1_002272 is 478042-93-2.
What is the molecular formula of Bionet1_002272?
The molecular formula of Bionet1_002272 is C20H15ClN2OS.
What is the molecular weight of Bionet1_002272?
The molecular weight of Bionet1_002272 is 366.06 g/mol.
Where can I buy Bionet1_002272?
You can request a quote for Bionet1_002272 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_002272?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_002272 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.