S-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate
TL;DR: S-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate (CAS 19200-30-7) is a chemical compound with molecular formula C11H21NO5S2 and molecular weight 311.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] N,N-diethylcarbamodithioate
Also Known As: S-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate, Diethyldithiocarbamic acid beta-D-glucopyranosyl ester, 1-S-(Diethylcarbamothioyl)-1-thio-beta-D-glucopyranose, N,N-Diethyldithiocarbamic acid beta-D-glucopyranosyl ester, [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] N,N-diethylcarbamodithioate
| Molecular Formula | C11H21NO5S2 |
|---|---|
| Molecular Weight | 311.09 g/mol |
| LogP | -0.8538 |
| Topological Polar Surface Area | 93.39 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.08612 |
| Heavy Atoms | 19 |
| Complexity | 300.81012 |
Chemical Identifiers
| CAS Number | 19200-30-7 |
|---|---|
| SMILES | CCN(CC)C(=S)S[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O |
Product Overview
S-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate (CAS 19200-30-7), with molecular formula C11H21NO5S2 and molecular weight 311.09 g/mol. IUPAC: [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] N,N-diethylcarbamodithioate.
Chemical Property Profile of S-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate
Property Insights of S-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate
The XLogP value of -0.8538 indicates that S-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 93.39 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate. Following Lipinski's Rule of Five, S-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate has 4 hydrogen bond donor(s) and 7 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-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate?
The CAS number of S-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate is 19200-30-7.
What is the molecular formula of S-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate?
The molecular formula of S-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate is C11H21NO5S2.
What is the molecular weight of S-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate?
The molecular weight of S-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate is 311.09 g/mol.
Where can I buy S-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate?
You can request a quote for S-(beta-D-Glucopyranosyl)-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-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate?
Yes, KEHONG BIO provides custom synthesis services for S-(beta-D-Glucopyranosyl)-N,N-diethyldithiocarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.