5N-720
TL;DR: 5N-720 (CAS 478050-10-1) is a chemical compound with molecular formula C13H11F3N4OS and molecular weight 328.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4,4-trifluorobut-3-enylsulfanyl)-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b]quinazolin-8-one
Also Known As: 5N-720, 2-[(3,4,4-trifluoro-3-butenyl)sulfanyl]-6,7-dihydro[1,2,4]triazolo[5,1-b]quinazolin-8(5H)-one, 2-(3,4,4-trifluorobut-3-enylsulfanyl)-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b]quinazolin-8-one, 2-[(3,4,4-trifluorobut-3-en-1-yl)sulfanyl]-5H,6H,7H,8H-[1,2,4]triazolo[3,2-b]quinazolin-8-one
| Molecular Formula | C13H11F3N4OS |
|---|---|
| Molecular Weight | 328.06 g/mol |
| LogP | 3.2031 |
| Topological Polar Surface Area | 60.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.06058 |
| Heavy Atoms | 22 |
| Complexity | 769.97614 |
Chemical Identifiers
| CAS Number | 478050-10-1 |
|---|---|
| SMILES | C1CC2=NC3=NC(=NN3C=C2C(=O)C1)SCCC(=C(F)F)F |
Product Overview
5N-720 (CAS 478050-10-1), with molecular formula C13H11F3N4OS and molecular weight 328.06 g/mol. IUPAC: 2-(3,4,4-trifluorobut-3-enylsulfanyl)-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b]quinazolin-8-one.
Chemical Property Profile of 5N-720
Property Insights of 5N-720
The XLogP value of 3.2031 indicates that 5N-720 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 5N-720. Following Lipinski's Rule of Five, 5N-720 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 5N-720?
The CAS number of 5N-720 is 478050-10-1.
What is the molecular formula of 5N-720?
The molecular formula of 5N-720 is C13H11F3N4OS.
What is the molecular weight of 5N-720?
The molecular weight of 5N-720 is 328.06 g/mol.
Where can I buy 5N-720?
You can request a quote for 5N-720 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5N-720?
Yes, KEHONG BIO provides custom synthesis services for 5N-720 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.