5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid
TL;DR: 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid (CAS 22445-21-2) is a chemical compound with molecular formula C17H31N5NiS and molecular weight 395.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid
Also Known As: 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid
| Molecular Formula | C17H31N5NiS |
|---|---|
| Molecular Weight | 395.17 g/mol |
| LogP | 4.40138 |
| Topological Polar Surface Area | 51.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 395.16534 |
| Heavy Atoms | 24 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 22445-21-2 |
|---|---|
| SMILES | CC1=NCC[N-]C(CC(=NCC[N-]C(C1)(C)C)C)(C)C.C(#N)S.[Ni+2] |
| InChIKey | XKZIRKUYZPKPHJ-UHFFFAOYSA-N |
Product Overview
5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid (CAS 22445-21-2), with molecular formula C17H31N5NiS and molecular weight 395.17 g/mol. IUPAC: 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid.
Chemical Property Profile of 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid
Property Insights of 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid
The XLogP value of 4.40138 indicates that 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.5 Ų, 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid has 1 hydrogen bond donor(s) and 6 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 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid?
The CAS number of 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid is 22445-21-2.
What is the molecular formula of 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid?
The molecular formula of 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid is C17H31N5NiS.
What is the molecular weight of 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid?
The molecular weight of 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid is 395.17 g/mol.
Where can I buy 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid?
You can request a quote for 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid?
Yes, KEHONG BIO provides custom synthesis services for 5,5,7,12,12,14-hexamethyl-1,8-diaza-4,11-diazanidacyclotetradeca-7,14-diene;nickel(2+);thiocyanic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.