F0648-0577
TL;DR: F0648-0577 (CAS 852153-44-7) is a chemical compound with molecular formula C22H26N6O4S and molecular weight 470.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[[4-(4-ethoxyphenyl)-5-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione
Also Known As: F0648-0577, 6-[[4-(4-ethoxyphenyl)-5-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione, 6-((4-(4-ethoxyphenyl)-5-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)pyrimidine-2,4(1H,3H)-dione, 6-{[4-(4-ethoxyphenyl)-5-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl]methyl}-1,2,3,4-tetrahydropyrimidine-2,4-dione
| Molecular Formula | C22H26N6O4S |
|---|---|
| Molecular Weight | 470.17 g/mol |
| LogP | 1.738 |
| Topological Polar Surface Area | 125.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 470.1736 |
| Heavy Atoms | 33 |
| Complexity | 1182.3643 |
Chemical Identifiers
| CAS Number | 852153-44-7 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N3CCCCC3)CC4=CC(=O)NC(=O)N4 |
Product Overview
F0648-0577 (CAS 852153-44-7), with molecular formula C22H26N6O4S and molecular weight 470.17 g/mol. IUPAC: 6-[[4-(4-ethoxyphenyl)-5-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione.
Chemical Property Profile of F0648-0577
Property Insights of F0648-0577
The XLogP value of 1.738 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0648-0577. The TPSA of 125.97 Ų falls within the moderate polarity range, balancing permeability and solubility for F0648-0577. Following Lipinski's Rule of Five, F0648-0577 has 2 hydrogen bond donor(s) and 7 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 F0648-0577?
The CAS number of F0648-0577 is 852153-44-7.
What is the molecular formula of F0648-0577?
The molecular formula of F0648-0577 is C22H26N6O4S.
What is the molecular weight of F0648-0577?
The molecular weight of F0648-0577 is 470.17 g/mol.
Where can I buy F0648-0577?
You can request a quote for F0648-0577 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0648-0577?
Yes, KEHONG BIO provides custom synthesis services for F0648-0577 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.