Bionet1_000760
TL;DR: Bionet1_000760 (CAS 338420-35-2) is a chemical compound with molecular formula C17H13F3N6O2 and molecular weight 390.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,4-dimethoxyphenyl)-12-(trifluoromethyl)-2,3,4,7,10-pentazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaen-8-amine
Also Known As: Bionet1_000760, 4G-053, 3-(3,4-dimethoxyphenyl)-8-(trifluoromethyl)pyrido[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-amine, 5-(3,4-dimethoxyphenyl)-12-(trifluoromethyl)-2,3,4,7,10-pentaazatricyclo[7.4.0.0^{2,6}]trideca-1(9),3,5,7,10,12-hexaen-8-amine, 5-(3,4-dimethoxyphenyl)-12-(trifluoromethyl)-2,3,4,7,10-pentazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaen-8-amine
| Molecular Formula | C17H13F3N6O2 |
|---|---|
| Molecular Weight | 390.11 g/mol |
| LogP | 2.9577 |
| Topological Polar Surface Area | 100.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 390.1052 |
| Heavy Atoms | 28 |
| Complexity | 1205.1511 |
Chemical Identifiers
| CAS Number | 338420-35-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=C3N=C(C4=C(N3N=N2)C=C(C=N4)C(F)(F)F)N)OC |
Product Overview
Bionet1_000760 (CAS 338420-35-2), with molecular formula C17H13F3N6O2 and molecular weight 390.11 g/mol. IUPAC: 5-(3,4-dimethoxyphenyl)-12-(trifluoromethyl)-2,3,4,7,10-pentazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaen-8-amine.
Chemical Property Profile of Bionet1_000760
Property Insights of Bionet1_000760
The XLogP value of 2.9577 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_000760. The TPSA of 100.45 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_000760. Following Lipinski's Rule of Five, Bionet1_000760 has 1 hydrogen bond donor(s) and 7 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_000760?
The CAS number of Bionet1_000760 is 338420-35-2.
What is the molecular formula of Bionet1_000760?
The molecular formula of Bionet1_000760 is C17H13F3N6O2.
What is the molecular weight of Bionet1_000760?
The molecular weight of Bionet1_000760 is 390.11 g/mol.
Where can I buy Bionet1_000760?
You can request a quote for Bionet1_000760 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_000760?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_000760 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.