F0654-1435
TL;DR: F0654-1435 (CAS 847191-50-8) is a chemical compound with molecular formula C20H23N5O3S2 and molecular weight 445.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-5-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl-7-thiophen-2-ylpyrimido[4,5-d]pyrimidine-2,4-dione
Also Known As: F0654-1435, 1,3-dimethyl-5-((2-(4-methylpiperidin-1-yl)-2-oxoethyl)thio)-7-(thiophen-2-yl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 1,3-dimethyl-5-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl-7-thiophen-2-ylpyrimido[4,5-d]pyrimidine-2,4-dione, 1,3-dimethyl-5-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-7-(thiophen-2-yl)-1H,2H,3H,4H-[1,3]diazino[4,5-d]pyrimidine-2,4-dione
| Molecular Formula | C20H23N5O3S2 |
|---|---|
| Molecular Weight | 445.12 g/mol |
| LogP | 2.1063 |
| Topological Polar Surface Area | 90.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 445.12424 |
| Heavy Atoms | 30 |
| Complexity | 1207.8855 |
Chemical Identifiers
| CAS Number | 847191-50-8 |
|---|---|
| SMILES | CC1CCN(CC1)C(=O)CSC2=NC(=NC3=C2C(=O)N(C(=O)N3C)C)C4=CC=CS4 |
Product Overview
F0654-1435 (CAS 847191-50-8), with molecular formula C20H23N5O3S2 and molecular weight 445.12 g/mol. IUPAC: 1,3-dimethyl-5-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl-7-thiophen-2-ylpyrimido[4,5-d]pyrimidine-2,4-dione.
Chemical Property Profile of F0654-1435
Property Insights of F0654-1435
The XLogP value of 2.1063 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0654-1435. The TPSA of 90.09 Ų falls within the moderate polarity range, balancing permeability and solubility for F0654-1435. Following Lipinski's Rule of Five, F0654-1435 has 0 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 F0654-1435?
The CAS number of F0654-1435 is 847191-50-8.
What is the molecular formula of F0654-1435?
The molecular formula of F0654-1435 is C20H23N5O3S2.
What is the molecular weight of F0654-1435?
The molecular weight of F0654-1435 is 445.12 g/mol.
Where can I buy F0654-1435?
You can request a quote for F0654-1435 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0654-1435?
Yes, KEHONG BIO provides custom synthesis services for F0654-1435 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.