1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone
TL;DR: 1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone (CAS 392308-83-7) is a chemical compound with molecular formula C11H15N3OS and molecular weight 237.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-piperidin-1-yl-2-pyrimidin-2-ylsulfanylethanone
Also Known As: 1-(piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone, 1-piperidyl-2-pyrimidin-2-ylthioethan-1-one, 1-piperidino-2-(2-pyrimidinylthio)-1-ethanone, 1-piperidin-1-yl-2-pyrimidin-2-ylsulfanylethanone, F1016-0033
| Molecular Formula | C11H15N3OS |
|---|---|
| Molecular Weight | 237.09 g/mol |
| LogP | 1.5812 |
| Topological Polar Surface Area | 46.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 237.09358 |
| Heavy Atoms | 16 |
| Complexity | 338.34274 |
Chemical Identifiers
| CAS Number | 392308-83-7 |
|---|---|
| SMILES | C1CCN(CC1)C(=O)CSC2=NC=CC=N2 |
Product Overview
1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone (CAS 392308-83-7), with molecular formula C11H15N3OS and molecular weight 237.09 g/mol. IUPAC: 1-piperidin-1-yl-2-pyrimidin-2-ylsulfanylethanone.
Chemical Property Profile of 1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone
Property Insights of 1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone
The XLogP value of 1.5812 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone. With a topological polar surface area (TPSA) of 46.09 Ų, 1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone has 0 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 1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone?
The CAS number of 1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone is 392308-83-7.
What is the molecular formula of 1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone?
The molecular formula of 1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone is C11H15N3OS.
What is the molecular weight of 1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone?
The molecular weight of 1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone is 237.09 g/mol.
Where can I buy 1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone?
You can request a quote for 1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(Piperidin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.