Bionet1_001887
TL;DR: Bionet1_001887 (CAS 306979-18-0) is a chemical compound with molecular formula C16H12F3N3OS and molecular weight 351.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrido[1,2-a][1,3,5]triazin-4-one
Also Known As: Bionet1_001887, 12J-564S, F2543-0429, 7-methyl-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-pyrido[1,2-a][1,3,5]triazin-4-one, 7-methyl-2-{[3-(trifluoromethyl)benzyl]sulfanyl}-4H-pyrido[1,2-a][1,3,5]triazin-4-one
| Molecular Formula | C16H12F3N3OS |
|---|---|
| Molecular Weight | 351.07 g/mol |
| LogP | 3.70902 |
| Topological Polar Surface Area | 47.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 351.0653 |
| Heavy Atoms | 24 |
| Complexity | 953.18585 |
Chemical Identifiers
| CAS Number | 306979-18-0 |
|---|---|
| SMILES | CC1=CN2C(=NC(=NC2=O)SCC3=CC(=CC=C3)C(F)(F)F)C=C1 |
Product Overview
Bionet1_001887 (CAS 306979-18-0), with molecular formula C16H12F3N3OS and molecular weight 351.07 g/mol. IUPAC: 7-methyl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrido[1,2-a][1,3,5]triazin-4-one.
Chemical Property Profile of Bionet1_001887
Property Insights of Bionet1_001887
The XLogP value of 3.70902 indicates that Bionet1_001887 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.26 Ų, Bionet1_001887 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_001887 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 Bionet1_001887?
The CAS number of Bionet1_001887 is 306979-18-0.
What is the molecular formula of Bionet1_001887?
The molecular formula of Bionet1_001887 is C16H12F3N3OS.
What is the molecular weight of Bionet1_001887?
The molecular weight of Bionet1_001887 is 351.07 g/mol.
Where can I buy Bionet1_001887?
You can request a quote for Bionet1_001887 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_001887?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_001887 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.