Nickel Pentamethylenedithiocarbamate
TL;DR: Nickel Pentamethylenedithiocarbamate (CAS 37329-02-5) is a chemical compound with molecular formula C12H20N2NiS4 and molecular weight 377.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
nickel(2+);bis(piperidine-1-carbodithioate)
Also Known As: Nickel Pentamethylenedithiocarbamate, EINECS 255-387-0
| Molecular Formula | C12H20N2NiS4 |
|---|---|
| Molecular Weight | 377.99 g/mol |
| LogP | 2.6057 |
| Topological Polar Surface Area | 6.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 377.98627 |
| Heavy Atoms | 19 |
| Complexity | 248.90295 |
Chemical Identifiers
| CAS Number | 37329-02-5 |
|---|---|
| SMILES | C1CCN(CC1)C(=S)[S-].C1CCN(CC1)C(=S)[S-].[Ni+2] |
Product Overview
Nickel Pentamethylenedithiocarbamate (CAS 37329-02-5), with molecular formula C12H20N2NiS4 and molecular weight 377.99 g/mol. IUPAC: nickel(2+);bis(piperidine-1-carbodithioate).
Chemical Property Profile of Nickel Pentamethylenedithiocarbamate
Property Insights of Nickel Pentamethylenedithiocarbamate
The XLogP value of 2.6057 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nickel Pentamethylenedithiocarbamate. With a topological polar surface area (TPSA) of 6.48 Ų, Nickel Pentamethylenedithiocarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nickel Pentamethylenedithiocarbamate 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 Nickel Pentamethylenedithiocarbamate?
The CAS number of Nickel Pentamethylenedithiocarbamate is 37329-02-5.
What is the molecular formula of Nickel Pentamethylenedithiocarbamate?
The molecular formula of Nickel Pentamethylenedithiocarbamate is C12H20N2NiS4.
What is the molecular weight of Nickel Pentamethylenedithiocarbamate?
The molecular weight of Nickel Pentamethylenedithiocarbamate is 377.99 g/mol.
Where can I buy Nickel Pentamethylenedithiocarbamate?
You can request a quote for Nickel Pentamethylenedithiocarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nickel Pentamethylenedithiocarbamate?
Yes, KEHONG BIO provides custom synthesis services for Nickel Pentamethylenedithiocarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.