4(1H)-Pyrimidinone, 5-chloro-2-(ethylthio)-
TL;DR: 4(1H)-Pyrimidinone, 5-chloro-2-(ethylthio)- (CAS 106146-79-6) is a chemical compound with molecular formula C6H7ClN2OS and molecular weight 189.99677 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-chloro-2-ethylsulfanyl-1H-pyrimidin-6-one
Also Known As: 4(1H)-Pyrimidinone, 5-chloro-2-(ethylthio)-, 5-chloro-2-ethylsulfanyl-1H-pyrimidin-6-one, 2-Ethylthio-5-chloro-pyrimidin-4(3H)-one, 5-Chloro-2-(ethylthio)pyrimidin-4(1H)-one, 2-ethylmercapto-5-chloro-3H-pyrimidin-4-one
Technical Specifications
| Molecular Formula | C6H7ClN2OS |
| Molecular Weight | 189.99677 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 189.99677 Da |
| Heavy Atoms | 11 |
| Complexity | 237.0 |
| SMILES | CCSC1=NC=C(C(=O)N1)Cl |
| InChIKey | DAEZJMUBVLKPBR-UHFFFAOYSA-N |
Chemical Property Profile of 4(1H)-Pyrimidinone, 5-chloro-2-(ethylthio)-
Property Insights of 4(1H)-Pyrimidinone, 5-chloro-2-(ethylthio)-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4(1H)-Pyrimidinone, 5-chloro-2-(ethylthio)-. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4(1H)-Pyrimidinone, 5-chloro-2-(ethylthio)-. Following Lipinski's Rule of Five, 4(1H)-Pyrimidinone, 5-chloro-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
What is the CAS number of 4(1H)-Pyrimidinone, 5-chloro-2-(ethylthio)-?
The CAS number of 4(1H)-Pyrimidinone, 5-chloro-2-(ethylthio)- is 106146-79-6.
What is the molecular formula of 4(1H)-Pyrimidinone, 5-chloro-2-(ethylthio)-?
The molecular formula of 4(1H)-Pyrimidinone, 5-chloro-2-(ethylthio)- is C6H7ClN2OS.
What is the molecular weight of 4(1H)-Pyrimidinone, 5-chloro-2-(ethylthio)-?
The molecular weight of 4(1H)-Pyrimidinone, 5-chloro-2-(ethylthio)- is 189.99677 g/mol.
Where can I buy 4(1H)-Pyrimidinone, 5-chloro-2-(ethylthio)-?
You can request a quote for 4(1H)-Pyrimidinone, 5-chloro-2-(ethylthio)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4(1H)-Pyrimidinone, 5-chloro-2-(ethylthio)-?
Yes, CoreyChem provides custom synthesis services for 4(1H)-Pyrimidinone, 5-chloro-2-(ethylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.