F0648-0726
TL;DR: F0648-0726 (CAS 852154-20-2) is a chemical compound with molecular formula C23H21FN6O4S and molecular weight 496.13 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-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethoxyphenyl)acetamide
Also Known As: F0648-0726, 2-((5-((2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-ethoxyphenyl)acetamide, 2-({5-[(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-ethoxyphenyl)acetamide, 2-[[5-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethoxyphenyl)acetamide
| Molecular Formula | C23H21FN6O4S |
|---|---|
| Molecular Weight | 496.13 g/mol |
| LogP | 2.5033 |
| Topological Polar Surface Area | 134.76 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 496.1329 |
| Heavy Atoms | 35 |
| Complexity | 1401.8947 |
Chemical Identifiers
| CAS Number | 852154-20-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)F)CC4=CC(=O)NC(=O)N4 |
Product Overview
F0648-0726 (CAS 852154-20-2), with molecular formula C23H21FN6O4S and molecular weight 496.13 g/mol. IUPAC: 2-[[5-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethoxyphenyl)acetamide.
Chemical Property Profile of F0648-0726
Property Insights of F0648-0726
The XLogP value of 2.5033 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0648-0726. The TPSA of 134.76 Ų falls within the moderate polarity range, balancing permeability and solubility for F0648-0726. Following Lipinski's Rule of Five, F0648-0726 has 3 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 F0648-0726?
The CAS number of F0648-0726 is 852154-20-2.
What is the molecular formula of F0648-0726?
The molecular formula of F0648-0726 is C23H21FN6O4S.
What is the molecular weight of F0648-0726?
The molecular weight of F0648-0726 is 496.13 g/mol.
Where can I buy F0648-0726?
You can request a quote for F0648-0726 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0648-0726?
Yes, KEHONG BIO provides custom synthesis services for F0648-0726 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.