Bionet1_003155
TL;DR: Bionet1_003155 (CAS 338747-67-4) is a chemical compound with molecular formula C13H10F3N5S2 and molecular weight 357.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-5-(4-methyl-5-prop-2-ynylsulfanyl-1,2,4-triazol-3-yl)-3-(trifluoromethyl)thieno[3,2-d]pyrazole
Also Known As: Bionet1_003155, 1-methyl-5-[4-methyl-5-(2-propynylsulfanyl)-4H-1,2,4-triazol-3-yl]-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole, 1-methyl-5-(4-methyl-5-prop-2-ynylsulfanyl-1,2,4-triazol-3-yl)-3-(trifluoromethyl)thieno[2,3-c]pyrazole, 4-methyl-3-[1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazol-5-yl]-5-(prop-2-yn-1-ylsulfanyl)-4H-1,2,4-triazole, 1-methyl-5-[4-methyl-5-(prop-2-ynylthio)-1,2,4-triazol-3-yl]-3-(trifluoromethyl)thieno[2,3-c]pyrazole
| Molecular Formula | C13H10F3N5S2 |
|---|---|
| Molecular Weight | 357.03 g/mol |
| LogP | 3.1744 |
| Topological Polar Surface Area | 48.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.03296 |
| Heavy Atoms | 23 |
| Complexity | 912.70123 |
Chemical Identifiers
| CAS Number | 338747-67-4 |
|---|---|
| SMILES | CN1C2=C(C=C(S2)C3=NN=C(N3C)SCC#C)C(=N1)C(F)(F)F |
Product Overview
Bionet1_003155 (CAS 338747-67-4), with molecular formula C13H10F3N5S2 and molecular weight 357.03 g/mol. IUPAC: 1-methyl-5-(4-methyl-5-prop-2-ynylsulfanyl-1,2,4-triazol-3-yl)-3-(trifluoromethyl)thieno[3,2-d]pyrazole.
Chemical Property Profile of Bionet1_003155
Property Insights of Bionet1_003155
The XLogP value of 3.1744 indicates that Bionet1_003155 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.53 Ų, Bionet1_003155 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_003155 has 0 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_003155?
The CAS number of Bionet1_003155 is 338747-67-4.
What is the molecular formula of Bionet1_003155?
The molecular formula of Bionet1_003155 is C13H10F3N5S2.
What is the molecular weight of Bionet1_003155?
The molecular weight of Bionet1_003155 is 357.03 g/mol.
Where can I buy Bionet1_003155?
You can request a quote for Bionet1_003155 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_003155?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_003155 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.