ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one
TL;DR: ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one (CAS 54803-00-8) is a chemical compound with molecular formula C13H22N2OS2 and molecular weight 286.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one
Also Known As: (C7-H13-N-S2.C6-H9-N-O)mult-, Ethenyl diethylcarbamadithioate, polymer with 1-ethenyl-2-pyrrolidinone, ethenyl N,N-diethylcarbamodithioate; 1-ethenylpyrrolidin-2-one, Carbamadithioic acid, diethyl-, ethenyl ester, polymer with 1-ethenyl-2-pyrrolidinone
| Molecular Formula | C13H22N2OS2 |
|---|---|
| Molecular Weight | 286.12 g/mol |
| LogP | 3.2421 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.11737 |
| Heavy Atoms | 18 |
| Complexity | 301.36636 |
Chemical Identifiers
| CAS Number | 54803-00-8 |
|---|---|
| SMILES | CCN(CC)C(=S)SC=C.C=CN1CCCC1=O |
Product Overview
ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one (CAS 54803-00-8), with molecular formula C13H22N2OS2 and molecular weight 286.12 g/mol. IUPAC: ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one.
Chemical Property Profile of ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one
Property Insights of ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one
The XLogP value of 3.2421 indicates that ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.55 Ų, ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one has 0 hydrogen bond donor(s) and 3 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 ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one?
The CAS number of ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one is 54803-00-8.
What is the molecular formula of ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one?
The molecular formula of ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one is C13H22N2OS2.
What is the molecular weight of ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one?
The molecular weight of ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one is 286.12 g/mol.
Where can I buy ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one?
You can request a quote for ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for ethenyl N,N-diethylcarbamodithioate;1-ethenylpyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.