butyl N,N-diethylcarbamodithioate
TL;DR: butyl N,N-diethylcarbamodithioate (CAS 19833-74-0) is a chemical compound with molecular formula C9H19NS2 and molecular weight 205.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl N,N-diethylcarbamodithioate
Also Known As: butyl N,N-diethyldithiocarbamate, N,N-diethyl(butylsulfanyl)carbothioamide, Diethyldithiocarbamic acid butyl ester, 1-butylsulfanyl-N,N-diethyl-methanethioamide, J2.394.449I
| Molecular Formula | C9H19NS2 |
|---|---|
| Molecular Weight | 205.10 g/mol |
| LogP | 3.1464 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 205.09589 |
| Heavy Atoms | 12 |
| Complexity | 121.696945 |
Chemical Identifiers
| CAS Number | 19833-74-0 |
|---|---|
| SMILES | CCCCSC(=S)N(CC)CC |
Product Overview
butyl N,N-diethylcarbamodithioate (CAS 19833-74-0), with molecular formula C9H19NS2 and molecular weight 205.10 g/mol. IUPAC: butyl N,N-diethylcarbamodithioate.
Chemical Property Profile of butyl N,N-diethylcarbamodithioate
Property Insights of butyl N,N-diethylcarbamodithioate
The XLogP value of 3.1464 indicates that butyl N,N-diethylcarbamodithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, butyl N,N-diethylcarbamodithioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, butyl N,N-diethylcarbamodithioate 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 butyl N,N-diethylcarbamodithioate?
The CAS number of butyl N,N-diethylcarbamodithioate is 19833-74-0.
What is the molecular formula of butyl N,N-diethylcarbamodithioate?
The molecular formula of butyl N,N-diethylcarbamodithioate is C9H19NS2.
What is the molecular weight of butyl N,N-diethylcarbamodithioate?
The molecular weight of butyl N,N-diethylcarbamodithioate is 205.10 g/mol.
Where can I buy butyl N,N-diethylcarbamodithioate?
You can request a quote for butyl N,N-diethylcarbamodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for butyl N,N-diethylcarbamodithioate?
Yes, KEHONG BIO provides custom synthesis services for butyl N,N-diethylcarbamodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.