![2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one structure](/static/products/6306/6306-09-8.webp)
2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
TL;DR: 2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one (CAS 6306-09-8) is a chemical compound with molecular formula C6H4N4OS2 and molecular weight 211.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,7-bis(sulfanylidene)-1,8-dihydropyrimido[4,5-d]pyrimidin-5-one
Also Known As: 2,7-bis(sulfanylidene)-1,8-dihydropyrimido[4,5-d]pyrimidin-5-one, 2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
| Molecular Formula | C6H4N4OS2 |
|---|---|
| Molecular Weight | 211.98 g/mol |
| LogP | 1.03828 |
| Topological Polar Surface Area | 77.33 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 211.98265 |
| Heavy Atoms | 13 |
| Complexity | 617.29736 |
Chemical Identifiers
| CAS Number | 6306-09-8 |
|---|---|
| SMILES | C1=NC(=S)NC2=C1C(=O)NC(=S)N2 |
Product Overview
2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one (CAS 6306-09-8), with molecular formula C6H4N4OS2 and molecular weight 211.98 g/mol. IUPAC: 2,7-bis(sulfanylidene)-1,8-dihydropyrimido[4,5-d]pyrimidin-5-one.
Chemical Property Profile of 2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Property Insights of 2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
The XLogP value of 1.03828 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one. The TPSA of 77.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one. Following Lipinski's Rule of Five, 2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one has 3 hydrogen bond donor(s) and 4 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 2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one?
The CAS number of 2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one is 6306-09-8.
What is the molecular formula of 2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one?
The molecular formula of 2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one is C6H4N4OS2.
What is the molecular weight of 2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one?
The molecular weight of 2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one is 211.98 g/mol.
Where can I buy 2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one?
You can request a quote for 2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2,7-Bis(sulfanylidene)-2,3,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.