5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one
TL;DR: 5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one (CAS 875-41-2) is a chemical compound with molecular formula C5H8N4OS and molecular weight 172.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-diamino-1-methyl-2-sulfanylidenepyrimidin-4-one
Also Known As: 5,6-diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one, 5,6-diamino-1-methyl-2-sulfanylidenepyrimidin-4-one, 5,6-diamino-1-methyl-2-sulfanyl-pyrimidin-4-one, 5,6-Diamino-1-methyl-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one, 5,6-diamino-4-hydroxy-1-methylpyrimidine-2-thione
| Molecular Formula | C5H8N4OS |
|---|---|
| Molecular Weight | 172.04 g/mol |
| LogP | -0.39271 |
| Topological Polar Surface Area | 89.83 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 172.04189 |
| Heavy Atoms | 11 |
| Complexity | 356.19937 |
Chemical Identifiers
| CAS Number | 875-41-2 |
|---|---|
| SMILES | CN1C(=C(C(=O)NC1=S)N)N |
Product Overview
5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one (CAS 875-41-2), with molecular formula C5H8N4OS and molecular weight 172.04 g/mol. IUPAC: 5,6-diamino-1-methyl-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of 5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one
Property Insights of 5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one
The XLogP value of -0.39271 indicates that 5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one. Following Lipinski's Rule of Five, 5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-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 5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one?
The CAS number of 5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one is 875-41-2.
What is the molecular formula of 5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one?
The molecular formula of 5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one is C5H8N4OS.
What is the molecular weight of 5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one?
The molecular weight of 5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one is 172.04 g/mol.
Where can I buy 5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one?
You can request a quote for 5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.