2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one
TL;DR: 2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one (CAS 2434-52-8) is a chemical compound with molecular formula C10H17N3OS and molecular weight 227.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(diethylamino)ethylsulfanyl]-1H-pyrimidin-6-one
Also Known As: 2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one, 2-(2-diethylaminoethylsulfanyl)-1H-pyrimidin-6-one, 2-[2-(diethylamino)ethylsulfanyl]-1H-pyrimidin-6-one, 2-(2-diethylaminoethylsulfanyl)-3H-pyrimidin-4-one, 2-{[2-(Diethylamino)ethyl]sulfanyl}pyrimidin-4(3H)-one
| Molecular Formula | C10H17N3OS |
|---|---|
| Molecular Weight | 227.11 g/mol |
| LogP | 1.2038 |
| Topological Polar Surface Area | 48.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 227.10924 |
| Heavy Atoms | 15 |
| Complexity | 335.43942 |
Chemical Identifiers
| CAS Number | 2434-52-8 |
|---|---|
| SMILES | CCN(CC)CCSC1=NC=CC(=O)N1 |
Product Overview
2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one (CAS 2434-52-8), with molecular formula C10H17N3OS and molecular weight 227.11 g/mol. IUPAC: 2-[2-(diethylamino)ethylsulfanyl]-1H-pyrimidin-6-one.
Chemical Property Profile of 2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one
Property Insights of 2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one
The XLogP value of 1.2038 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one. With a topological polar surface area (TPSA) of 48.99 Ų, 2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one has 1 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 2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one?
The CAS number of 2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one is 2434-52-8.
What is the molecular formula of 2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one?
The molecular formula of 2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one is C10H17N3OS.
What is the molecular weight of 2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one?
The molecular weight of 2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one is 227.11 g/mol.
Where can I buy 2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one?
You can request a quote for 2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-((2-(Diethylamino)ethyl)thio)pyrimidin-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.