3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate
TL;DR: 3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate (CAS 725243-08-3) is a chemical compound with molecular formula C13H22N2OS2 and molecular weight 286.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-oxo-3-piperidin-1-ylpropyl) pyrrolidine-1-carbodithioate
Also Known As: 3-oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate, (3-oxo-3-piperidin-1-ylpropyl) pyrrolidine-1-carbodithioate
| Molecular Formula | C13H22N2OS2 |
|---|---|
| Molecular Weight | 286.12 g/mol |
| LogP | 2.5029 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 286.11737 |
| Heavy Atoms | 18 |
| Complexity | 297.36636 |
Chemical Identifiers
| CAS Number | 725243-08-3 |
|---|---|
| SMILES | C1CCN(CC1)C(=O)CCSC(=S)N2CCCC2 |
Product Overview
3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate (CAS 725243-08-3), with molecular formula C13H22N2OS2 and molecular weight 286.12 g/mol. IUPAC: (3-oxo-3-piperidin-1-ylpropyl) pyrrolidine-1-carbodithioate.
Chemical Property Profile of 3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate
Property Insights of 3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate
The XLogP value of 2.5029 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate. With a topological polar surface area (TPSA) of 23.55 Ų, 3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate has 0 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 3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate?
The CAS number of 3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate is 725243-08-3.
What is the molecular formula of 3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate?
The molecular formula of 3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate is C13H22N2OS2.
What is the molecular weight of 3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate?
The molecular weight of 3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate is 286.12 g/mol.
Where can I buy 3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate?
You can request a quote for 3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate?
Yes, KEHONG BIO provides custom synthesis services for 3-Oxo-3-(piperidin-1-yl)propyl pyrrolidine-1-carbodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.