Bionet1_002140
TL;DR: Bionet1_002140 (CAS 338966-88-4) is a chemical compound with molecular formula C19H11F3N6 and molecular weight 380.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-[2-[4-(trifluoromethyl)anilino]ethenyl]-2,3,7,11-tetrazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaene-5-carbonitrile
Also Known As: Bionet1_002140, 6-{2-[4-(trifluoromethyl)anilino]vinyl}pyrazolo[1,5-a]pyrido[3,4-e]pyrimidine-3-carbonitrile
| Molecular Formula | C19H11F3N6 |
|---|---|
| Molecular Weight | 380.10 g/mol |
| LogP | 4.25078 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 380.09973 |
| Heavy Atoms | 28 |
| Complexity | 1232.9727 |
Chemical Identifiers
| CAS Number | 338966-88-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C(F)(F)F)NC=CC2=NC=CC3=C2C=NC4=C(C=NN34)C#N |
Product Overview
Bionet1_002140 (CAS 338966-88-4), with molecular formula C19H11F3N6 and molecular weight 380.10 g/mol. IUPAC: 10-[2-[4-(trifluoromethyl)anilino]ethenyl]-2,3,7,11-tetrazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaene-5-carbonitrile.
Chemical Property Profile of Bionet1_002140
Property Insights of Bionet1_002140
The XLogP value of 4.25078 indicates that Bionet1_002140 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_002140. Following Lipinski's Rule of Five, Bionet1_002140 has 1 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_002140?
The CAS number of Bionet1_002140 is 338966-88-4.
What is the molecular formula of Bionet1_002140?
The molecular formula of Bionet1_002140 is C19H11F3N6.
What is the molecular weight of Bionet1_002140?
The molecular weight of Bionet1_002140 is 380.10 g/mol.
Where can I buy Bionet1_002140?
You can request a quote for Bionet1_002140 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_002140?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_002140 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.