S-Propyl N,N-diethyldithiocarbamate
TL;DR: S-Propyl N,N-diethyldithiocarbamate (CAS 19047-77-9) is a chemical compound with molecular formula C8H17NS2 and molecular weight 191.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl N,N-diethylcarbamodithioate
Also Known As: S-Propyl N,N-diethyldithiocarbamate, propyl diethylcarbamodithioate, starbld0001431, propyl N,N-diethylcarbamodithioate, Propyl diethyldithiocarbamate #
| Molecular Formula | C8H17NS2 |
|---|---|
| Molecular Weight | 191.08 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 60.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 191.08025 |
| Heavy Atoms | 11 |
| Complexity | 111.0 |
Chemical Identifiers
| CAS Number | 19047-77-9 |
|---|---|
| SMILES | CCCSC(=S)N(CC)CC |
| InChIKey | YSSAGHQOEYPLQO-UHFFFAOYSA-N |
Product Overview
S-Propyl N,N-diethyldithiocarbamate (CAS 19047-77-9), with molecular formula C8H17NS2 and molecular weight 191.08 g/mol. IUPAC: propyl N,N-diethylcarbamodithioate.
Chemical Property Profile of S-Propyl N,N-diethyldithiocarbamate
Property Insights of S-Propyl N,N-diethyldithiocarbamate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-Propyl N,N-diethyldithiocarbamate. The TPSA of 60.6 Ų falls within the moderate polarity range, balancing permeability and solubility for S-Propyl N,N-diethyldithiocarbamate. Following Lipinski's Rule of Five, S-Propyl N,N-diethyldithiocarbamate has 0 hydrogen bond donor(s) and 2 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 S-Propyl N,N-diethyldithiocarbamate?
The CAS number of S-Propyl N,N-diethyldithiocarbamate is 19047-77-9.
What is the molecular formula of S-Propyl N,N-diethyldithiocarbamate?
The molecular formula of S-Propyl N,N-diethyldithiocarbamate is C8H17NS2.
What is the molecular weight of S-Propyl N,N-diethyldithiocarbamate?
The molecular weight of S-Propyl N,N-diethyldithiocarbamate is 191.08 g/mol.
Where can I buy S-Propyl N,N-diethyldithiocarbamate?
You can request a quote for S-Propyl N,N-diethyldithiocarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-Propyl N,N-diethyldithiocarbamate?
Yes, KEHONG BIO provides custom synthesis services for S-Propyl N,N-diethyldithiocarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.