3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate
TL;DR: 3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate (CAS 328009-66-1) is a chemical compound with molecular formula C11H19NO2S2 and molecular weight 261.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,3-dimethyl-2-oxobutyl) morpholine-4-carbodithioate
Also Known As: starbld0013151, 3,3-dimethyl-2-oxobutyl morpholine-4-carbodithioate, (3,3-dimethyl-2-oxobutyl) morpholine-4-carbodithioate, (3,3-dimethyl-2-oxo-butyl) morpholine-4-carbodithioate
| Molecular Formula | C11H19NO2S2 |
|---|---|
| Molecular Weight | 261.09 g/mol |
| LogP | 1.9519 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.08572 |
| Heavy Atoms | 16 |
| Complexity | 267.64835 |
Chemical Identifiers
| CAS Number | 328009-66-1 |
|---|---|
| SMILES | CC(C)(C)C(=O)CSC(=S)N1CCOCC1 |
Product Overview
3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate (CAS 328009-66-1), with molecular formula C11H19NO2S2 and molecular weight 261.09 g/mol. IUPAC: (3,3-dimethyl-2-oxobutyl) morpholine-4-carbodithioate.
Chemical Property Profile of 3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate
Property Insights of 3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate
The XLogP value of 1.9519 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate. With a topological polar surface area (TPSA) of 29.54 Ų, 3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate 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 3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate?
The CAS number of 3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate is 328009-66-1.
What is the molecular formula of 3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate?
The molecular formula of 3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate is C11H19NO2S2.
What is the molecular weight of 3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate?
The molecular weight of 3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate is 261.09 g/mol.
Where can I buy 3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate?
You can request a quote for 3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dimethyl-2-oxobutyl morpholine-4-carbodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.