Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel structure

Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel

TL;DR: Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel (CAS 76984-10-6) is a chemical compound with molecular formula C14H20N2NiS4 and molecular weight 401.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

bis(N,N-bis(prop-2-enyl)carbamodithioate);nickel(2+)

Also Known As: starbld0007482, Bis((diallylcarbamothioyl)thio)nickel, Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel, N,N-bis(prop-2-enyl)carbamodithioate;nickel(2+), IUPAC: (diprop-2-enylamino)methanedithioate; Nickel(+2) Cation

CAS: 76984-10-6
Molecular Formula C14H20N2NiS4
Molecular Weight 401.99 g/mol
LogP 2.9819
Topological Polar Surface Area 6.48 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 8
Exact Mass 401.98627
Heavy Atoms 21
Complexity 304.88318

Chemical Identifiers

CAS Number 76984-10-6
SMILES C=CCN(CC=C)C(=S)[S-].C=CCN(CC=C)C(=S)[S-].[Ni+2]

Product Overview

Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel (CAS 76984-10-6), with molecular formula C14H20N2NiS4 and molecular weight 401.99 g/mol. IUPAC: bis(N,N-bis(prop-2-enyl)carbamodithioate);nickel(2+).

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel

XLogP
2.9819
TPSA (Topological Polar Surface Area)
6.48
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
8
Heavy Atoms
21
Complexity
304.88318
Exact Mass
401.98627
Monoisotopic Mass
401.98627
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel

The XLogP value of 2.9819 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel. With a topological polar surface area (TPSA) of 6.48 Ų, Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel 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

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel?

The CAS number of Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel is 76984-10-6.

What is the molecular formula of Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel?

The molecular formula of Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel is C14H20N2NiS4.

What is the molecular weight of Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel?

The molecular weight of Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel is 401.99 g/mol.

Where can I buy Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel?

You can request a quote for Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel?

Yes, KEHONG BIO provides custom synthesis services for Bis({[bis(prop-2-en-1-yl)carbamothioyl]sulfanyl})nickel and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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