2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone)
TL;DR: 2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone) (CAS 36137-18-5) is a chemical compound with molecular formula C10H8N4O2S and molecular weight 248.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-5-phenyldiazenyl-2-sulfanylidene-1H-pyrimidin-4-one
Also Known As: AB00074864-01, AE-848/30739057, 2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone), 4,5,6(1H)-Pyrimidinetrione, dihydro-2-thioxo-, 5-(phenylhydr, 5-(phenylhydrazinylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C10H8N4O2S |
|---|---|
| Molecular Weight | 248.04 g/mol |
| LogP | 2.55349 |
| Topological Polar Surface Area | 93.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.0368 |
| Heavy Atoms | 17 |
| Complexity | 659.9964 |
Chemical Identifiers
| CAS Number | 36137-18-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)N=NC2=C(NC(=S)NC2=O)O |
Product Overview
2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone) (CAS 36137-18-5), with molecular formula C10H8N4O2S and molecular weight 248.04 g/mol. IUPAC: 6-hydroxy-5-phenyldiazenyl-2-sulfanylidene-1H-pyrimidin-4-one.
Chemical Property Profile of 2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone)
Property Insights of 2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone)
The XLogP value of 2.55349 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone). The TPSA of 93.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone). Following Lipinski's Rule of Five, 2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone) has 3 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 2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone)?
The CAS number of 2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone) is 36137-18-5.
What is the molecular formula of 2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone)?
The molecular formula of 2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone) is C10H8N4O2S.
What is the molecular weight of 2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone)?
The molecular weight of 2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone) is 248.04 g/mol.
Where can I buy 2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone)?
You can request a quote for 2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone)?
Yes, KEHONG BIO provides custom synthesis services for 2-thioxodihydro-4,5,6(1H)-pyrimidinetrione 5-(phenylhydrazone) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.