F0648-0309
TL;DR: F0648-0309 (CAS 852048-48-7) is a chemical compound with molecular formula C21H21N7O4S and molecular weight 467.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(2,5-dimethylphenyl)-5-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Also Known As: F0648-0309, 2-((4-(2,5-dimethylphenyl)-5-((2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-methylisoxazol-3-yl)acetamide, 2-[[4-(2,5-dimethylphenyl)-5-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide, 2-{[4-(2,5-dimethylphenyl)-5-[(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(5-methyl-1,2-oxazol-3-yl)acetamide
| Molecular Formula | C21H21N7O4S |
|---|---|
| Molecular Weight | 467.14 g/mol |
| LogP | 1.87876 |
| Topological Polar Surface Area | 151.56 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 467.13757 |
| Heavy Atoms | 33 |
| Complexity | 1404.6337 |
Chemical Identifiers
| CAS Number | 852048-48-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)N2C(=NN=C2SCC(=O)NC3=NOC(=C3)C)CC4=CC(=O)NC(=O)N4 |
Product Overview
F0648-0309 (CAS 852048-48-7), with molecular formula C21H21N7O4S and molecular weight 467.14 g/mol. IUPAC: 2-[[4-(2,5-dimethylphenyl)-5-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide.
Chemical Property Profile of F0648-0309
Property Insights of F0648-0309
The XLogP value of 1.87876 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0648-0309. The TPSA of 151.56 Ų indicates high polarity, suggesting F0648-0309 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0648-0309 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 F0648-0309?
The CAS number of F0648-0309 is 852048-48-7.
What is the molecular formula of F0648-0309?
The molecular formula of F0648-0309 is C21H21N7O4S.
What is the molecular weight of F0648-0309?
The molecular weight of F0648-0309 is 467.14 g/mol.
Where can I buy F0648-0309?
You can request a quote for F0648-0309 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0648-0309?
Yes, KEHONG BIO provides custom synthesis services for F0648-0309 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.