二亚戊基硫代氨基甲酰二硫化物
TL;DR: 二亚戊基硫代氨基甲酰二硫化物 (CAS 94-37-1) is a chemical compound with molecular formula C12H20N2S4 and molecular weight 320.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二亚戊基硫代氨基甲酰二硫化物
piperidine-1-carbothioylsulfanyl piperidine-1-carbodithioate
Also Known As: Dicyclopentamethylenethiuram disulfide, Dipentamethylenethiuram disulfide, 1-Piperidinethiocarbonyl disulfide, Bis(pentamethylene)thiuram disulfide, Bis(1-piperidylthiocarbonyl) disulfide
| Molecular Formula | C12H20N2S4 |
|---|---|
| Molecular Weight | 320.05 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.05093 |
| Heavy Atoms | 18 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 94-37-1 |
|---|---|
| SMILES | C1CCN(CC1)C(=S)SSC(=S)N2CCCCC2 |
| InChIKey | KNBRWWCHBRQLNY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二亚戊基硫代氨基甲酰二硫化物 (CAS 94-37-1), with molecular formula C12H20N2S4 and molecular weight 320.05 g/mol. IUPAC: piperidine-1-carbothioylsulfanyl piperidine-1-carbodithioate.
Chemical Property Profile of 二亚戊基硫代氨基甲酰二硫化物
Property Insights of 二亚戊基硫代氨基甲酰二硫化物
The XLogP value of 3.4 indicates that 二亚戊基硫代氨基甲酰二硫化物 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 二亚戊基硫代氨基甲酰二硫化物. Following Lipinski's Rule of Five, 二亚戊基硫代氨基甲酰二硫化物 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 二亚戊基硫代氨基甲酰二硫化物?
The CAS number of 二亚戊基硫代氨基甲酰二硫化物 is 94-37-1.
What is the molecular formula of 二亚戊基硫代氨基甲酰二硫化物?
The molecular formula of 二亚戊基硫代氨基甲酰二硫化物 is C12H20N2S4.
What is the molecular weight of 二亚戊基硫代氨基甲酰二硫化物?
The molecular weight of 二亚戊基硫代氨基甲酰二硫化物 is 320.05 g/mol.
Where can I buy 二亚戊基硫代氨基甲酰二硫化物?
You can request a quote for 二亚戊基硫代氨基甲酰二硫化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二亚戊基硫代氨基甲酰二硫化物?
Yes, KEHONG BIO provides custom synthesis services for 二亚戊基硫代氨基甲酰二硫化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.