2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate
TL;DR: 2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate (CAS 724779-47-9) is a chemical compound with molecular formula C16H18N2O2S2 and molecular weight 334.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] morpholine-4-carbodithioate
Also Known As: 2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate, [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] morpholine-4-carbodithioate, 1-(2-methylindol-3-yl)-2-(morpholin-4-ylthioxomethylthio)ethan-1-one, Morpholine-4-carbodithioic acid 2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl ester
| Molecular Formula | C16H18N2O2S2 |
|---|---|
| Molecular Weight | 334.08 g/mol |
| LogP | 3.00932 |
| Topological Polar Surface Area | 45.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 334.08096 |
| Heavy Atoms | 22 |
| Complexity | 705.23376 |
Chemical Identifiers
| CAS Number | 724779-47-9 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1)C(=O)CSC(=S)N3CCOCC3 |
Product Overview
2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate (CAS 724779-47-9), with molecular formula C16H18N2O2S2 and molecular weight 334.08 g/mol. IUPAC: [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] morpholine-4-carbodithioate.
Chemical Property Profile of 2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate
Property Insights of 2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate
The XLogP value of 3.00932 indicates that 2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.33 Ų, 2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate has 1 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 2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate?
The CAS number of 2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate is 724779-47-9.
What is the molecular formula of 2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate?
The molecular formula of 2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate is C16H18N2O2S2.
What is the molecular weight of 2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate?
The molecular weight of 2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate is 334.08 g/mol.
Where can I buy 2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate?
You can request a quote for 2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-methyl-1H-indol-3-yl)-2-oxoethyl morpholine-4-carbodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.