5-Amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one
TL;DR: 5-Amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one (CAS 105760-98-3) is a chemical compound with molecular formula C6H9N3OS and molecular weight 171.04663 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-amino-2-ethylsulfanyl-1H-pyrimidin-6-one
Also Known As: 2,4'-Methylenediphenol, 5-amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one, 5-amino-2-ethylsulfanyl-1H-pyrimidin-6-one, 5-amino-2-(ethylsulfanyl)pyrimidin-4-ol, 2-ethylmercapto-5-amino-3H-pyrimidin-4-one
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H9N3OS |
| Molecular Weight | 171.04663 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 92.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 171.04663 Da |
| Heavy Atoms | 11 |
| Complexity | 234.0 |
| SMILES | CCSC1=NC=C(C(=O)N1)N |
| InChIKey | QDJFYPJDXCWGLG-UHFFFAOYSA-N |
Chemical Property Profile of 5-Amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one
Property Insights of 5-Amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one. The TPSA of 92.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one. Following Lipinski's Rule of Five, 5-Amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one?
The CAS number of 5-Amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one is 105760-98-3.
What is the molecular formula of 5-Amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one?
The molecular formula of 5-Amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one is C6H9N3OS.
What is the molecular weight of 5-Amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one?
The molecular weight of 5-Amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one is 171.04663 g/mol.
Where can I buy 5-Amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one?
You can request a quote for 5-Amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one?
Yes, CoreyChem provides custom synthesis services for 5-Amino-2-(ethylsulfanyl)pyrimidin-4(3h)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.