3,3-Dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate)
TL;DR: 3,3-Dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate) (CAS 372155-59-4) is a chemical compound with molecular formula C20H38N2OS4 and molecular weight 450.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(dipropylcarbamothioylsulfanyl)-3,3-dimethyl-2-oxobutyl] N,N-dipropylcarbamodithioate
Also Known As: 3,3-dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate), [1-(dipropylcarbamothioylsulfanyl)-3,3-dimethyl-2-oxobutyl] N,N-dipropylcarbamodithioate
| Molecular Formula | C20H38N2OS4 |
|---|---|
| Molecular Weight | 450.19 g/mol |
| LogP | 6.2079 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 450.1867 |
| Heavy Atoms | 27 |
| Complexity | 435.0924 |
Chemical Identifiers
| CAS Number | 372155-59-4 |
|---|---|
| SMILES | CCCN(CCC)C(=S)SC(C(=O)C(C)(C)C)SC(=S)N(CCC)CCC |
Product Overview
3,3-Dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate) (CAS 372155-59-4), with molecular formula C20H38N2OS4 and molecular weight 450.19 g/mol. IUPAC: [1-(dipropylcarbamothioylsulfanyl)-3,3-dimethyl-2-oxobutyl] N,N-dipropylcarbamodithioate.
Chemical Property Profile of 3,3-Dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate)
Property Insights of 3,3-Dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate)
The XLogP value of 6.2079 indicates that 3,3-Dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.55 Ų, 3,3-Dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate) has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,3-Dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate)?
The CAS number of 3,3-Dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate) is 372155-59-4.
What is the molecular formula of 3,3-Dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate)?
The molecular formula of 3,3-Dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate) is C20H38N2OS4.
What is the molecular weight of 3,3-Dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate)?
The molecular weight of 3,3-Dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate) is 450.19 g/mol.
Where can I buy 3,3-Dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate)?
You can request a quote for 3,3-Dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate) 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-oxobutane-1,1-diyl bis(dipropylcarbamodithioate)?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dimethyl-2-oxobutane-1,1-diyl bis(dipropylcarbamodithioate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.