F0654-0013
TL;DR: F0654-0013 (CAS 852167-87-4) is a chemical compound with molecular formula C16H21N5O3S and molecular weight 363.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,7-trimethyl-5-(2-oxo-2-piperidin-1-ylethyl)sulfanylpyrimido[4,5-d]pyrimidine-2,4-dione
Also Known As: F0654-0013, 1,3,7-trimethyl-5-(2-oxo-2-piperidin-1-ylethyl)sulfanylpyrimido[4,5-d]pyrimidine-2,4-dione, 1,3,7-trimethyl-5-((2-oxo-2-(piperidin-1-yl)ethyl)thio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C16H21N5O3S |
|---|---|
| Molecular Weight | 363.14 g/mol |
| LogP | 0.44022 |
| Topological Polar Surface Area | 90.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.1365 |
| Heavy Atoms | 25 |
| Complexity | 943.40643 |
Chemical Identifiers
| CAS Number | 852167-87-4 |
|---|---|
| SMILES | CC1=NC2=C(C(=N1)SCC(=O)N3CCCCC3)C(=O)N(C(=O)N2C)C |
Product Overview
F0654-0013 (CAS 852167-87-4), with molecular formula C16H21N5O3S and molecular weight 363.14 g/mol. IUPAC: 1,3,7-trimethyl-5-(2-oxo-2-piperidin-1-ylethyl)sulfanylpyrimido[4,5-d]pyrimidine-2,4-dione.
Chemical Property Profile of F0654-0013
Property Insights of F0654-0013
The XLogP value of 0.44022 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0654-0013. The TPSA of 90.09 Ų falls within the moderate polarity range, balancing permeability and solubility for F0654-0013. Following Lipinski's Rule of Five, F0654-0013 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 F0654-0013?
The CAS number of F0654-0013 is 852167-87-4.
What is the molecular formula of F0654-0013?
The molecular formula of F0654-0013 is C16H21N5O3S.
What is the molecular weight of F0654-0013?
The molecular weight of F0654-0013 is 363.14 g/mol.
Where can I buy F0654-0013?
You can request a quote for F0654-0013 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0654-0013?
Yes, KEHONG BIO provides custom synthesis services for F0654-0013 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.