4-Pyrimidinol, 2-(ethylthio)-
TL;DR: 4-Pyrimidinol, 2-(ethylthio)- (CAS 88404-25-5) is a chemical compound with molecular formula C6H8N2OS and molecular weight 156.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylsulfanyl-1H-pyrimidin-6-one
Also Known As: 4-pyrimidinol, 2-(ethylthio)-, 2- -4-pyrimidinol, 2-(Ethylthio)pyrimidin-4(1H)-one, 2-ethylthiopyrimidin-4-ol, 2-(Ethylthio)-4-pyrimidinol
| Molecular Formula | C6H8N2OS |
|---|---|
| Molecular Weight | 156.04 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 156.03574 |
| Heavy Atoms | 10 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 88404-25-5 |
|---|---|
| SMILES | CCSC1=NC=CC(=O)N1 |
| InChIKey | OEHRELACOJFJQI-UHFFFAOYSA-N |
Product Overview
4-Pyrimidinol, 2-(ethylthio)- (CAS 88404-25-5), with molecular formula C6H8N2OS and molecular weight 156.04 g/mol. IUPAC: 2-ethylsulfanyl-1H-pyrimidin-6-one.
Chemical Property Profile of 4-Pyrimidinol, 2-(ethylthio)-
Property Insights of 4-Pyrimidinol, 2-(ethylthio)-
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Pyrimidinol, 2-(ethylthio)-. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Pyrimidinol, 2-(ethylthio)-. Following Lipinski's Rule of Five, 4-Pyrimidinol, 2-(ethylthio)- has 1 hydrogen bond donor(s) and 3 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 4-Pyrimidinol, 2-(ethylthio)-?
The CAS number of 4-Pyrimidinol, 2-(ethylthio)- is 88404-25-5.
What is the molecular formula of 4-Pyrimidinol, 2-(ethylthio)-?
The molecular formula of 4-Pyrimidinol, 2-(ethylthio)- is C6H8N2OS.
What is the molecular weight of 4-Pyrimidinol, 2-(ethylthio)-?
The molecular weight of 4-Pyrimidinol, 2-(ethylthio)- is 156.04 g/mol.
Where can I buy 4-Pyrimidinol, 2-(ethylthio)-?
You can request a quote for 4-Pyrimidinol, 2-(ethylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pyrimidinol, 2-(ethylthio)-?
Yes, KEHONG BIO provides custom synthesis services for 4-Pyrimidinol, 2-(ethylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.