F0654-0769
TL;DR: F0654-0769 (CAS 863003-30-9) is a chemical compound with molecular formula C19H17ClN4O3S and molecular weight 416.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-7-cyclopropyl-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione
Also Known As: F0654-0769, 5-((2-(4-chlorophenyl)-2-oxoethyl)thio)-7-cyclopropyl-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-7-cyclopropyl-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione, 5-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-7-cyclopropyl-1,3-dimethyl-1H,2H,3H,4H-[1,3]diazino[4,5-d]pyrimidine-2,4-dione
| Molecular Formula | C19H17ClN4O3S |
|---|---|
| Molecular Weight | 416.07 g/mol |
| LogP | 2.533 |
| Topological Polar Surface Area | 86.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 416.07098 |
| Heavy Atoms | 28 |
| Complexity | 1213.0514 |
Chemical Identifiers
| CAS Number | 863003-30-9 |
|---|---|
| SMILES | CN1C2=C(C(=NC(=N2)C3CC3)SCC(=O)C4=CC=C(C=C4)Cl)C(=O)N(C1=O)C |
Product Overview
F0654-0769 (CAS 863003-30-9), with molecular formula C19H17ClN4O3S and molecular weight 416.07 g/mol. IUPAC: 5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-7-cyclopropyl-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione.
Chemical Property Profile of F0654-0769
Property Insights of F0654-0769
The XLogP value of 2.533 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0654-0769. The TPSA of 86.85 Ų falls within the moderate polarity range, balancing permeability and solubility for F0654-0769. Following Lipinski's Rule of Five, F0654-0769 has 0 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 F0654-0769?
The CAS number of F0654-0769 is 863003-30-9.
What is the molecular formula of F0654-0769?
The molecular formula of F0654-0769 is C19H17ClN4O3S.
What is the molecular weight of F0654-0769?
The molecular weight of F0654-0769 is 416.07 g/mol.
Where can I buy F0654-0769?
You can request a quote for F0654-0769 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0654-0769?
Yes, KEHONG BIO provides custom synthesis services for F0654-0769 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.