Bionet1_003134
TL;DR: Bionet1_003134 (CAS 343373-44-4) is a chemical compound with molecular formula C14H7F3N6O5 and molecular weight 396.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-pyridin-2-yl-1,2,4-triazol-3-one
Also Known As: Bionet1_003134, 2-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(2-pyridinyl)-2,4-dihydro-3H-1,2,4-triazol-3-one, 6N-067, 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazol-5-one, 2-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-pyridin-2-yl-1,2,4-triazol-3-one
| Molecular Formula | C14H7F3N6O5 |
|---|---|
| Molecular Weight | 396.04 g/mol |
| LogP | 2.2534 |
| Topological Polar Surface Area | 138.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 396.043 |
| Heavy Atoms | 28 |
| Complexity | 1103.3541 |
Chemical Identifiers
| CAS Number | 343373-44-4 |
|---|---|
| SMILES | C1=CC=NC(=C1)N2C=NN(C2=O)C3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-] |
Product Overview
Bionet1_003134 (CAS 343373-44-4), with molecular formula C14H7F3N6O5 and molecular weight 396.04 g/mol. IUPAC: 2-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-pyridin-2-yl-1,2,4-triazol-3-one.
Chemical Property Profile of Bionet1_003134
Property Insights of Bionet1_003134
The XLogP value of 2.2534 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_003134. The TPSA of 138.99 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_003134. Following Lipinski's Rule of Five, Bionet1_003134 has 0 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_003134?
The CAS number of Bionet1_003134 is 343373-44-4.
What is the molecular formula of Bionet1_003134?
The molecular formula of Bionet1_003134 is C14H7F3N6O5.
What is the molecular weight of Bionet1_003134?
The molecular weight of Bionet1_003134 is 396.04 g/mol.
Where can I buy Bionet1_003134?
You can request a quote for Bionet1_003134 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_003134?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_003134 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.