![7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione structure](/static/products/7403/7403-28-3.webp)
7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
TL;DR: 7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione (CAS 7403-28-3) is a chemical compound with molecular formula C8H8N4O2S and molecular weight 224.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylsulfanyl-8H-pyrimido[4,5-d]pyrimidine-5,7-dione
Also Known As: 2-ethylsulfanyl-8H-pyrimido[4,5-d]pyrimidine-5,7-dione, 7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 7-(Ethylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C8H8N4O2S |
|---|---|
| Molecular Weight | 224.04 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.0368 |
| Heavy Atoms | 15 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 7403-28-3 |
|---|---|
| SMILES | CCSC1=NC=C2C(=N1)NC(=O)NC2=O |
| InChIKey | GJPBFNCKTGVJLO-UHFFFAOYSA-N |
Product Overview
7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione (CAS 7403-28-3), with molecular formula C8H8N4O2S and molecular weight 224.04 g/mol. IUPAC: 2-ethylsulfanyl-8H-pyrimido[4,5-d]pyrimidine-5,7-dione.
Chemical Property Profile of 7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Property Insights of 7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, 7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione has 2 hydrogen bond donor(s) and 5 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 7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione?
The CAS number of 7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione is 7403-28-3.
What is the molecular formula of 7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione?
The molecular formula of 7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione is C8H8N4O2S.
What is the molecular weight of 7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione?
The molecular weight of 7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione is 224.04 g/mol.
Where can I buy 7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione?
You can request a quote for 7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-(Ethylthio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.