2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate
TL;DR: 2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate (CAS 338394-08-4) is a chemical compound with molecular formula C10H15N3O3S2 and molecular weight 289.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(3-oxopyrazolidin-1-yl)ethyl] morpholine-4-carbodithioate
Also Known As: 2B-072, 2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate, 2-oxo-2-(3-oxopyrazolidin-1-yl)ethyl morpholine-4-carbodithioate, [2-oxo-2-(3-oxopyrazolidin-1-yl)ethyl] morpholine-4-carbodithioate, 2-oxo-2-(3-oxopyrazolidin-1-yl)ethylmorpholine-4-carbodithioate
| Molecular Formula | C10H15N3O3S2 |
|---|---|
| Molecular Weight | 289.06 g/mol |
| LogP | -0.3998 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.05548 |
| Heavy Atoms | 18 |
| Complexity | 358.27707 |
Chemical Identifiers
| CAS Number | 338394-08-4 |
|---|---|
| SMILES | C1CN(NC1=O)C(=O)CSC(=S)N2CCOCC2 |
Product Overview
2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate (CAS 338394-08-4), with molecular formula C10H15N3O3S2 and molecular weight 289.06 g/mol. IUPAC: [2-oxo-2-(3-oxopyrazolidin-1-yl)ethyl] morpholine-4-carbodithioate.
Chemical Property Profile of 2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate
Property Insights of 2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate
The XLogP value of -0.3998 indicates that 2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate. Following Lipinski's Rule of Five, 2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate has 1 hydrogen bond donor(s) and 5 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-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate?
The CAS number of 2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate is 338394-08-4.
What is the molecular formula of 2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate?
The molecular formula of 2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate is C10H15N3O3S2.
What is the molecular weight of 2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate?
The molecular weight of 2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate is 289.06 g/mol.
Where can I buy 2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate?
You can request a quote for 2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate?
Yes, KEHONG BIO provides custom synthesis services for 2-oxo-2-(3-oxotetrahydro-1H-pyrazol-1-yl)ethyl 4-morpholinecarbodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.