Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]-
TL;DR: Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]- (CAS 46129-87-7) is a chemical compound with molecular formula C5H8N2NiS4 and molecular weight 281.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
nickel(2+);N-[3-(sulfidocarbothioylamino)propyl]carbamodithioate
Also Known As: (C5-H8-N2-Ni-S4)x-, (Trimethylenebis(dithiocarbamato))nickel polymers, Nickel, (trimethylenebis(dithiocarbamato))-, polymers, Nickel, [trimethylenebis[dithiocarbamato]]-, polymers, Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]-
| Molecular Formula | C5H8N2NiS4 |
|---|---|
| Molecular Weight | 281.89 g/mol |
| LogP | 0.2168 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.89236 |
| Heavy Atoms | 12 |
| Complexity | 136.38365 |
Chemical Identifiers
| CAS Number | 46129-87-7 |
|---|---|
| SMILES | C(CNC(=S)[S-])CNC(=S)[S-].[Ni+2] |
Product Overview
Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]- (CAS 46129-87-7), with molecular formula C5H8N2NiS4 and molecular weight 281.89 g/mol. IUPAC: nickel(2+);N-[3-(sulfidocarbothioylamino)propyl]carbamodithioate.
Chemical Property Profile of Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]-
Property Insights of Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]-
The XLogP value of 0.2168 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]-. With a topological polar surface area (TPSA) of 24.06 Ų, Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]- has 2 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, [[1,3-propanediylbis[carbamodithioato]](2-)]-?
The CAS number of Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]- is 46129-87-7.
What is the molecular formula of Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]-?
The molecular formula of Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]- is C5H8N2NiS4.
What is the molecular weight of Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]-?
The molecular weight of Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]- is 281.89 g/mol.
Where can I buy Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]-?
You can request a quote for Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]-?
Yes, KEHONG BIO provides custom synthesis services for Nickel, [[1,3-propanediylbis[carbamodithioato]](2-)]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.