F0654-0164
TL;DR: F0654-0164 (CAS 852169-58-5) is a chemical compound with molecular formula C18H18FN5O3S and molecular weight 403.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(7-ethyl-1,3-dimethyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl)sulfanyl-N-(2-fluorophenyl)acetamide
Also Known As: F0654-0164, 2-((2-ethyl-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)thio)-N-(2-fluorophenyl)acetamide, 2-({2-ethyl-6,8-dimethyl-5,7-dioxo-5H,6H,7H,8H-[1,3]diazino[4,5-d]pyrimidin-4-yl}sulfanyl)-N-(2-fluorophenyl)acetamide, 2-(7-ethyl-1,3-dimethyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl)sulfanyl-N-(2-fluorophenyl)acetamide
| Molecular Formula | C18H18FN5O3S |
|---|---|
| Molecular Weight | 403.11 g/mol |
| LogP | 1.4595 |
| Topological Polar Surface Area | 98.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.11145 |
| Heavy Atoms | 28 |
| Complexity | 1188.2803 |
Chemical Identifiers
| CAS Number | 852169-58-5 |
|---|---|
| SMILES | CCC1=NC2=C(C(=N1)SCC(=O)NC3=CC=CC=C3F)C(=O)N(C(=O)N2C)C |
Product Overview
F0654-0164 (CAS 852169-58-5), with molecular formula C18H18FN5O3S and molecular weight 403.11 g/mol. IUPAC: 2-(7-ethyl-1,3-dimethyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl)sulfanyl-N-(2-fluorophenyl)acetamide.
Chemical Property Profile of F0654-0164
Property Insights of F0654-0164
The XLogP value of 1.4595 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0654-0164. The TPSA of 98.88 Ų falls within the moderate polarity range, balancing permeability and solubility for F0654-0164. Following Lipinski's Rule of Five, F0654-0164 has 1 hydrogen bond donor(s) and 6 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 F0654-0164?
The CAS number of F0654-0164 is 852169-58-5.
What is the molecular formula of F0654-0164?
The molecular formula of F0654-0164 is C18H18FN5O3S.
What is the molecular weight of F0654-0164?
The molecular weight of F0654-0164 is 403.11 g/mol.
Where can I buy F0654-0164?
You can request a quote for F0654-0164 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0654-0164?
Yes, KEHONG BIO provides custom synthesis services for F0654-0164 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.