Bionet1_002653
TL;DR: Bionet1_002653 (CAS 339111-47-6) is a chemical compound with molecular formula C13H16F3N5O2S and molecular weight 363.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-N,3-N,5-N,5-N-tetramethyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-1,2,4-triazole-3,5-diamine
Also Known As: Bionet1_002653, N~3~,N~3~,N~5~,N~5~-tetramethyl-1-{[3-(trifluoromethyl)phenyl]sulfonyl}-1H-1,2,4-triazole-3,5-diamine, N3,N3,N5,N5-tetramethyl-1-[3-(trifluoromethyl)benzenesulfonyl]-1H-1,2,4-triazole-3,5-diamine, 3-N,3-N,5-N,5-N-tetramethyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-1,2,4-triazole-3,5-diamine, N3,N3,N5,N5-tetramethyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-1,2,4-triazole-3,5-diamine
| Molecular Formula | C13H16F3N5O2S |
|---|---|
| Molecular Weight | 363.10 g/mol |
| LogP | 1.6659 |
| Topological Polar Surface Area | 71.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 363.0977 |
| Heavy Atoms | 24 |
| Complexity | 843.53235 |
Chemical Identifiers
| CAS Number | 339111-47-6 |
|---|---|
| SMILES | CN(C)C1=NN(C(=N1)N(C)C)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F |
Product Overview
Bionet1_002653 (CAS 339111-47-6), with molecular formula C13H16F3N5O2S and molecular weight 363.10 g/mol. IUPAC: 3-N,3-N,5-N,5-N-tetramethyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-1,2,4-triazole-3,5-diamine.
Chemical Property Profile of Bionet1_002653
Property Insights of Bionet1_002653
The XLogP value of 1.6659 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_002653. The TPSA of 71.33 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_002653. Following Lipinski's Rule of Five, Bionet1_002653 has 0 hydrogen bond donor(s) and 6 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_002653?
The CAS number of Bionet1_002653 is 339111-47-6.
What is the molecular formula of Bionet1_002653?
The molecular formula of Bionet1_002653 is C13H16F3N5O2S.
What is the molecular weight of Bionet1_002653?
The molecular weight of Bionet1_002653 is 363.10 g/mol.
Where can I buy Bionet1_002653?
You can request a quote for Bionet1_002653 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_002653?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_002653 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.