bis(4-dimethylaminodithiobenzil)nickel
TL;DR: bis(4-dimethylaminodithiobenzil)nickel (CAS 38465-55-3) is a chemical compound with molecular formula C32H30N2NiS4-4 and molecular weight 628.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(1-[4-(dimethylamino)phenyl]-2-phenylethene-1,2-dithiolate);nickel
Also Known As: bis(4-dimethylaminodithiobenzil)nickel, 1-[4-(dimethylamino)phenyl]-2-phenylethene-1,2-dithiolate;nickel, Nickel, bis[1-[4-(dimethylamino)phenyl]-2-phenyl-1,2-ethenedithiolato(2-)-kappaS,kappaS']-, BDN, Nickel, bis[1-[4-(dimethylamino)phenyl]-2-phenyl-1,2-ethenedithiolato(2-)-.kappa.S,.kappa.S']-
| Molecular Formula | C32H30N2NiS4-4 |
|---|---|
| Molecular Weight | 628.06 g/mol |
| LogP | 7.3419 |
| Topological Polar Surface Area | 10.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 628.0645 |
| Heavy Atoms | 39 |
| Complexity | 692.0 |
Chemical Identifiers
| CAS Number | 38465-55-3 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C(=C(C2=CC=CC=C2)[S-])[S-].CN(C)C1=CC=C(C=C1)C(=C(C2=CC=CC=C2)[S-])[S-].[Ni] |
| InChIKey | LDYCDKFAGIOUDE-UHFFFAOYSA-J |
Product Overview
bis(4-dimethylaminodithiobenzil)nickel (CAS 38465-55-3), with molecular formula C32H30N2NiS4-4 and molecular weight 628.06 g/mol. IUPAC: bis(1-[4-(dimethylamino)phenyl]-2-phenylethene-1,2-dithiolate);nickel.
Chemical Property Profile of bis(4-dimethylaminodithiobenzil)nickel
Property Insights of bis(4-dimethylaminodithiobenzil)nickel
The XLogP value of 7.3419 indicates that bis(4-dimethylaminodithiobenzil)nickel is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 10.5 Ų, bis(4-dimethylaminodithiobenzil)nickel exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, bis(4-dimethylaminodithiobenzil)nickel has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of bis(4-dimethylaminodithiobenzil)nickel?
The CAS number of bis(4-dimethylaminodithiobenzil)nickel is 38465-55-3.
What is the molecular formula of bis(4-dimethylaminodithiobenzil)nickel?
The molecular formula of bis(4-dimethylaminodithiobenzil)nickel is C32H30N2NiS4-4.
What is the molecular weight of bis(4-dimethylaminodithiobenzil)nickel?
The molecular weight of bis(4-dimethylaminodithiobenzil)nickel is 628.06 g/mol.
Where can I buy bis(4-dimethylaminodithiobenzil)nickel?
You can request a quote for bis(4-dimethylaminodithiobenzil)nickel directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for bis(4-dimethylaminodithiobenzil)nickel?
Yes, KEHONG BIO provides custom synthesis services for bis(4-dimethylaminodithiobenzil)nickel and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.