F0648-0083
TL;DR: F0648-0083 (CAS 852047-08-6) is a chemical compound with molecular formula C19H17N7O4S and molecular weight 439.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Also Known As: F0648-0083, 2-((5-((2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N-(5-methylisoxazol-3-yl)acetamide, 2-[[5-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide, 2-({5-[(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
| Molecular Formula | C19H17N7O4S |
|---|---|
| Molecular Weight | 439.11 g/mol |
| LogP | 1.26192 |
| Topological Polar Surface Area | 151.56 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 439.10626 |
| Heavy Atoms | 31 |
| Complexity | 1294.5323 |
Chemical Identifiers
| CAS Number | 852047-08-6 |
|---|---|
| SMILES | CC1=CC(=NO1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CC4=CC(=O)NC(=O)N4 |
Product Overview
F0648-0083 (CAS 852047-08-6), with molecular formula C19H17N7O4S and molecular weight 439.11 g/mol. IUPAC: 2-[[5-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide.
Chemical Property Profile of F0648-0083
Property Insights of F0648-0083
The XLogP value of 1.26192 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0648-0083. The TPSA of 151.56 Ų indicates high polarity, suggesting F0648-0083 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0648-0083 has 3 hydrogen bond donor(s) and 8 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 F0648-0083?
The CAS number of F0648-0083 is 852047-08-6.
What is the molecular formula of F0648-0083?
The molecular formula of F0648-0083 is C19H17N7O4S.
What is the molecular weight of F0648-0083?
The molecular weight of F0648-0083 is 439.11 g/mol.
Where can I buy F0648-0083?
You can request a quote for F0648-0083 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0648-0083?
Yes, KEHONG BIO provides custom synthesis services for F0648-0083 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.