7N-708
TL;DR: 7N-708 (CAS 339019-97-5) is a chemical compound with molecular formula C11H8F3N5O2S and molecular weight 331.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitro-2-[3-(3,4,4-trifluorobut-3-enylsulfanyl)-1,2,4-triazol-1-yl]pyridine
Also Known As: 7N-708, 3-nitro-2-{3-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-1H-1,2,4-triazol-1-yl}pyridine, 3-nitro-2-[3-(3,4,4-trifluorobut-3-enylsulfanyl)-1,2,4-triazol-1-yl]pyridine, 3-nitro-2-{3-[(3,4,4-trifluorobut-3-en-1-yl)sulfanyl]-1H-1,2,4-triazol-1-yl}pyridine, 3-nitro-2-{3-[(3,4,4-trifluorobut-3-en-1-yl)sulfanyl]-1,2,4-triazol-1-yl}pyridine
| Molecular Formula | C11H8F3N5O2S |
|---|---|
| Molecular Weight | 331.04 g/mol |
| LogP | 3.1303 |
| Topological Polar Surface Area | 86.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 331.0351 |
| Heavy Atoms | 22 |
| Complexity | 717.258 |
Chemical Identifiers
| CAS Number | 339019-97-5 |
|---|---|
| SMILES | C1=CC(=C(N=C1)N2C=NC(=N2)SCCC(=C(F)F)F)[N+](=O)[O-] |
Product Overview
7N-708 (CAS 339019-97-5), with molecular formula C11H8F3N5O2S and molecular weight 331.04 g/mol. IUPAC: 3-nitro-2-[3-(3,4,4-trifluorobut-3-enylsulfanyl)-1,2,4-triazol-1-yl]pyridine.
Chemical Property Profile of 7N-708
Property Insights of 7N-708
The XLogP value of 3.1303 indicates that 7N-708 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 7N-708. Following Lipinski's Rule of Five, 7N-708 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 7N-708?
The CAS number of 7N-708 is 339019-97-5.
What is the molecular formula of 7N-708?
The molecular formula of 7N-708 is C11H8F3N5O2S.
What is the molecular weight of 7N-708?
The molecular weight of 7N-708 is 331.04 g/mol.
Where can I buy 7N-708?
You can request a quote for 7N-708 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7N-708?
Yes, KEHONG BIO provides custom synthesis services for 7N-708 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.