Bionet1_004381
TL;DR: Bionet1_004381 (CAS 477857-06-0) is a chemical compound with molecular formula C18H13F3N4S and molecular weight 374.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-methylphenyl)-3-[4-(trifluoromethyl)phenyl]-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Also Known As: Bionet1_004381, 6-(4-methylphenyl)-3-[4-(trifluoromethyl)phenyl]-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine, 11P-176, 6-(p-tolyl)-3-[4-(trifluoromethyl)phenyl]-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
| Molecular Formula | C18H13F3N4S |
|---|---|
| Molecular Weight | 374.08 g/mol |
| LogP | 4.63042 |
| Topological Polar Surface Area | 43.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 374.0813 |
| Heavy Atoms | 26 |
| Complexity | 973.16595 |
Chemical Identifiers
| CAS Number | 477857-06-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN3C(=NN=C3SC2)C4=CC=C(C=C4)C(F)(F)F |
Product Overview
Bionet1_004381 (CAS 477857-06-0), with molecular formula C18H13F3N4S and molecular weight 374.08 g/mol. IUPAC: 6-(4-methylphenyl)-3-[4-(trifluoromethyl)phenyl]-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine.
Chemical Property Profile of Bionet1_004381
Property Insights of Bionet1_004381
The XLogP value of 4.63042 indicates that Bionet1_004381 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.07 Ų, Bionet1_004381 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_004381 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_004381?
The CAS number of Bionet1_004381 is 477857-06-0.
What is the molecular formula of Bionet1_004381?
The molecular formula of Bionet1_004381 is C18H13F3N4S.
What is the molecular weight of Bionet1_004381?
The molecular weight of Bionet1_004381 is 374.08 g/mol.
Where can I buy Bionet1_004381?
You can request a quote for Bionet1_004381 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_004381?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_004381 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.