F0654-0238
TL;DR: F0654-0238 (CAS 863002-39-5) is a chemical compound with molecular formula C16H17N5O2S and molecular weight 343.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-ethyl-1,3-dimethyl-5-(pyridin-2-ylmethylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione
Also Known As: F0654-0238, 7-ethyl-1,3-dimethyl-5-((pyridin-2-ylmethyl)thio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 7-ethyl-1,3-dimethyl-5-(pyridin-2-ylmethylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione, 7-ethyl-1,3-dimethyl-5-{[(pyridin-2-yl)methyl]sulfanyl}-1H,2H,3H,4H-[1,3]diazino[4,5-d]pyrimidine-2,4-dione
| Molecular Formula | C16H17N5O2S |
|---|---|
| Molecular Weight | 343.11 g/mol |
| LogP | 1.2769 |
| Topological Polar Surface Area | 82.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.1103 |
| Heavy Atoms | 24 |
| Complexity | 1010.882 |
Chemical Identifiers
| CAS Number | 863002-39-5 |
|---|---|
| SMILES | CCC1=NC2=C(C(=N1)SCC3=CC=CC=N3)C(=O)N(C(=O)N2C)C |
Product Overview
F0654-0238 (CAS 863002-39-5), with molecular formula C16H17N5O2S and molecular weight 343.11 g/mol. IUPAC: 7-ethyl-1,3-dimethyl-5-(pyridin-2-ylmethylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione.
Chemical Property Profile of F0654-0238
Property Insights of F0654-0238
The XLogP value of 1.2769 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0654-0238. The TPSA of 82.67 Ų falls within the moderate polarity range, balancing permeability and solubility for F0654-0238. Following Lipinski's Rule of Five, F0654-0238 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 F0654-0238?
The CAS number of F0654-0238 is 863002-39-5.
What is the molecular formula of F0654-0238?
The molecular formula of F0654-0238 is C16H17N5O2S.
What is the molecular weight of F0654-0238?
The molecular weight of F0654-0238 is 343.11 g/mol.
Where can I buy F0654-0238?
You can request a quote for F0654-0238 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0654-0238?
Yes, KEHONG BIO provides custom synthesis services for F0654-0238 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.